curcumin [Ligand Id: 7000] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL140
  • acetylcholinesterase (Cartwright blood group)/Acetylcholinesterase in Human [ChEMBL: CHEMBL220] [GtoPdb: 2465] [UniProtKB: P22303]
  • This target only has 0 pki data point
  • 0
1 CHEMBL140_lig_chart_1 Acetylcholinesterase Human
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  • Aminopeptidase N in Human [ChEMBL: CHEMBL1907] [GtoPdb: 1560] [UniProtKB: P15144]
  • This target only has 0 pki data point
  • 0
2 CHEMBL140_lig_chart_2 Aminopeptidase N Human
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  • 5-LOX/Arachidonate 5-lipoxygenase in Human [ChEMBL: CHEMBL215] [GtoPdb: 1385] [UniProtKB: P09917]
  • This target only has 0 pki data point
  • 0
3 CHEMBL140_lig_chart_3 Arachidonate 5-lipoxygenase Human
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  • Beta amyloid A4 protein in Human [ChEMBL: CHEMBL2487] [UniProtKB: P05067]
  • This target only has 0 pki data point
  • 0
4 CHEMBL140_lig_chart_4 Beta amyloid A4 protein Human
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  • butyrylcholinesterase/Butyrylcholinesterase in Human [ChEMBL: CHEMBL1914] [GtoPdb: 2471] [UniProtKB: P06276]
  • This target only has 0 pki data point
  • 0
5 CHEMBL140_lig_chart_5 Butyrylcholinesterase Human
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  • CDGSH iron-sulfur domain-containing protein 1 in Human [ChEMBL: CHEMBL1795168] [UniProtKB: Q9NZ45]
  • This target only has 1 pki data point
  • 7
6 CHEMBL140_lig_chart_6 CDGSH iron-sulfur domain-containing protein 1 Human
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  • Coagulation factor III in Human [ChEMBL: CHEMBL4081] [UniProtKB: P13726]
  • This target only has 0 pki data point
  • 0
7 CHEMBL140_lig_chart_7 Coagulation factor III Human
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  • CREB binding protein/CREB-binding protein in Human [ChEMBL: CHEMBL5747] [GtoPdb: 2734] [UniProtKB: Q92793]
  • This target only has 0 pki data point
  • 0
8 CHEMBL140_lig_chart_8 CREB-binding protein Human
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  • epidermal growth factor receptor/Epidermal growth factor receptor erbB1 in Human [ChEMBL: CHEMBL203] [GtoPdb: 1797] [UniProtKB: P00533]
  • This target only has 0 pki data point
  • 0
9 CHEMBL140_lig_chart_9 Epidermal growth factor receptor erbB1 Human
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  • hydroxysteroid 17-beta dehydrogenase 2/Estradiol 17-beta-dehydrogenase 2 in Human [ChEMBL: CHEMBL2789] [GtoPdb: 3094] [UniProtKB: P37059]
  • This target only has 0 pki data point
  • 0
10 CHEMBL140_lig_chart_10 Estradiol 17-beta-dehydrogenase 2 Human
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  • glycogen synthase kinase 3 beta/Glycogen synthase kinase-3 beta in Human [ChEMBL: CHEMBL262] [GtoPdb: 2030] [UniProtKB: P49841]
  • glycogen synthase kinase 3 beta/Glycogen synthase kinase-3 beta in Rat [ChEMBL: CHEMBL3669] [GtoPdb: 2030] [UniProtKB: P18266]
  • This target only has 0 pki data point
  • 0
11 CHEMBL140_lig_chart_11 Glycogen synthase kinase-3 beta HumanRat
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  • Glyoxalase I in Human [ChEMBL: CHEMBL2424] [UniProtKB: Q04760]
  • This target only has 1 pki data point
  • 8.3
12 CHEMBL140_lig_chart_12 Glyoxalase I Human
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  • GroEL/GroES in Escherichia coli [ChEMBL: CHEMBL4106139] [UniProtKB: Q548M1Q7BGE6]
  • This target only has 0 pki data point
  • 0
13 CHEMBL140_lig_chart_13 GroEL/GroES Escherichia coli
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  • E1A binding protein p300/Histone acetyltransferase p300 in Human [ChEMBL: CHEMBL3784] [GtoPdb: 2735] [UniProtKB: Q09472]
  • This target only has 0 pki data point
  • 0
14 CHEMBL140_lig_chart_14 Histone acetyltransferase p300 Human
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15 CHEMBL140_lig_chart_15 HSP60/HSP10 Human
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  • lysine demethylase 1A/Lysine-specific histone demethylase 1 in Human [ChEMBL: CHEMBL6136] [GtoPdb: 2669] [UniProtKB: O60341]
  • This target only has 0 pki data point
  • 0
16 CHEMBL140_lig_chart_16 Lysine-specific histone demethylase 1 Human
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  • Microtubule-associated protein tau in Human [ChEMBL: CHEMBL1293224] [UniProtKB: P10636]
  • This target only has 0 pki data point
  • 0
17 CHEMBL140_lig_chart_17 Microtubule-associated protein tau Human
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  • Monoamine oxidase A in Human [ChEMBL: CHEMBL1951] [GtoPdb: 2489] [UniProtKB: P21397]
  • This target only has 1 pki data point
  • 6.15
18 CHEMBL140_lig_chart_18 Monoamine oxidase A Human
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  • Monoamine oxidase B in Human [ChEMBL: CHEMBL2039] [GtoPdb: 2490] [UniProtKB: P27338]
  • This target only has 1 pki data point
  • 4.67
19 CHEMBL140_lig_chart_19 Monoamine oxidase B Human
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  • nuclear factor, erythroid 2 like 2/Nuclear factor erythroid 2-related factor 2 in Human [ChEMBL: CHEMBL1075094] [GtoPdb: 3057] [UniProtKB: Q16236]
  • This target only has 0 pki data point
  • 0
20 CHEMBL140_lig_chart_20 Nuclear factor erythroid 2-related factor 2 Human
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  • Plasmodium falciparum 3D7 [ChEMBL: CHEMBL2366922]
  • This target only has 0 pki data point
  • 0
21 CHEMBL140_lig_chart_21 Plasmodium falciparum 3D7 Plasmodium falciparum 3D7
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  • mPGES1/Prostaglandin E synthase in Human [ChEMBL: CHEMBL5658] [GtoPdb: 1377] [UniProtKB: O14684]
  • This target only has 0 pki data point
  • 0
22 CHEMBL140_lig_chart_22 Prostaglandin E synthase Human
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  • proteasome 20S subunit beta 5/Proteasome Macropain subunit MB1 in Human [ChEMBL: CHEMBL4662] [GtoPdb: 2406] [UniProtKB: P28074]
  • This target only has 0 pki data point
  • 0
23 CHEMBL140_lig_chart_23 Proteasome Macropain subunit MB1 Human
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  • Sarcoplasmic/endoplasmic reticulum calcium ATP-ase in Rabbit [ChEMBL: CHEMBL4693] [UniProtKB: P04191]
  • This target only has 1 pki data point
  • 5.24
24 CHEMBL140_lig_chart_24 Sarcoplasmic/endoplasmic reticulum calcium ATP-ase Rabbit
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  • SERCA2/Sarcoplasmic/endoplasmic reticulum calcium ATPase 2 in Human [ChEMBL: CHEMBL3901] [GtoPdb: 841] [UniProtKB: P16615]
  • This target only has 1 pki data point
  • 4.28
25 CHEMBL140_lig_chart_25 Sarcoplasmic/endoplasmic reticulum calcium ATPase 2 Human
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  • SERCA3/Sarcoplasmic/endoplasmic reticulum calcium ATPase 3 in Human [ChEMBL: CHEMBL2401] [GtoPdb: 842] [UniProtKB: Q93084]
  • This target only has 1 pki data point
  • 5.07
26 CHEMBL140_lig_chart_26 Sarcoplasmic/endoplasmic reticulum calcium ATPase 3 Human
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  • p21 (RAC1) activated kinase 1/Serine/threonine-protein kinase PAK 1 in Human [ChEMBL: CHEMBL4600] [GtoPdb: 2133] [UniProtKB: Q13153]
  • This target only has 0 pki data point
  • 0
27 CHEMBL140_lig_chart_27 Serine/threonine-protein kinase PAK 1 Human
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  • Sortase A in Streptococcus mutans [ChEMBL: CHEMBL4523939] [UniProtKB: Q8CM62]
  • This target only has 0 pki data point
  • 0
28 CHEMBL140_lig_chart_28 Sortase A Streptococcus mutans
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  • SRC proto-oncogene, non-receptor tyrosine kinase/Tyrosine-protein kinase SRC in Mouse [ChEMBL: CHEMBL3074] [GtoPdb: 2206] [UniProtKB: P05480]
  • This target only has 0 pki data point
  • 0
29 CHEMBL140_lig_chart_29 Tyrosine-protein kinase SRC Mouse
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
acetylcholinesterase (Cartwright blood group)/Acetylcholinesterase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL220] [GtoPdb: 2465] [UniProtKB: P22303]
ChEMBL Inhibition of human erythrocyte AChE using acetylthiocholine chloride as substrate pretreated for 15 mins followed by substrate addition measured for 2 mins by DTNB reagent based spectrophotometric method B 5.3 pIC50 >5000 nM IC50 Eur J Med Chem (2017) 130: 139-153 [PMID:28242549]
Aminopeptidase N in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1907] [GtoPdb: 1560] [UniProtKB: P15144]
ChEMBL Inhibition of APN (unknown origin) B 4.81 pIC50 15500 nM IC50 J Med Chem (2018) 61: 6468-6490 [PMID:29630364]
5-LOX/Arachidonate 5-lipoxygenase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL215] [GtoPdb: 1385] [UniProtKB: P09917]
ChEMBL Inhibition of human PMNL 5-LOX using arachidonic acid as substrate after 5 mins by HPLC method B 4.52 pIC50 30000 nM IC50 Bioorg Med Chem (2019) 27: 3745-3759 [PMID:31331653]
Beta amyloid A4 protein in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2487] [UniProtKB: P05067]
ChEMBL Inhibition of HFIP-pretreated amyloid beta (1 to 42 residues) (unknown origin) self aggregation after 24 hrs by ThT-based fluorometric method B 4.65 pIC50 22510 nM IC50 Eur J Med Chem (2017) 136: 36-51 [PMID:28478343]
ChEMBL Inhibition of HFIP-pretreated amyloid beta (1 to 42) (unknown origin) self-induced aggregation after 48 hrs by thioflavin-T fluorescence assay B 4.66 pIC50 21810 nM IC50 Eur J Med Chem (2017) 125: 736-750 [PMID:27721157]
ChEMBL Inhibition of self-induced amyloid beta (1 to 42) (unknown origin) aggregation incubated for 48 hrs measured after 5 mins by thioflavin-T fluorescence assay B 4.66 pIC50 21810 nM IC50 Bioorg. Med. Chem. (2016) 24: 3829-3841 [PMID:27353888]
ChEMBL Inhibition of HFIP-pretreated amyloid beta (1 to 42) (unknown origin) self-induced aggregation incubated for 24 hrs under dark condition by thioflavin-T based fluorometric assay B 4.73 pIC50 18730 nM IC50 Eur J Med Chem (2017) 127: 174-186 [PMID:28061347]
ChEMBL Inhibition of HFIP-pretreated amyloid beta (1 to 42) (unknown origin) self-induced aggregation after 24 hrs by thioflavin-T fluorescence assay B 4.73 pIC50 18730 nM IC50 Bioorg Med Chem (2018) 26: 5759-5765 [PMID:30360953]
ChEMBL Inhibition of self-mediated amyloid beta (1 to 42) (unknown origin) aggregation after 48 hrs by thioflavin T fluorescence assay B 4.74 pIC50 18250 nM IC50 Eur J Med Chem (2016) 122: 17-26 [PMID:27343850]
ChEMBL Inhibition of amyloid beta (1 to 42) (unknown origin) self-aggregation after 24 hrs by thioflavin-T fluorescence assay B 4.82 pIC50 14990 nM IC50 Eur J Med Chem (2018) 151: 351-362 [PMID:29635167]
ChEMBL Inhibition of self-induced aggregation of amyloid beta (1 to 42) (unknown origin) after 48 hrs by thioflavin T-based fluorescence method B 4.86 pIC50 13700 nM IC50 MedChemComm (2018) 9: 1862-1870
ChEMBL Inhibition of self-mediated amyloid beta (1 to 42) (unknown origin) aggregation after 10 hrs by thioflavin T based fluorometric assay B 4.95 pIC50 11300 nM IC50 Bioorg. Med. Chem. Lett. (2016) 26: 747-750 [PMID:26783181]
ChEMBL Inhibition of human amyloid beta (1 to 42) aggregation after 46 to 48 hrs by Thioflavin T fluorescence assay B 5 pIC50 10000 nM IC50 J Nat Prod (2017) 80: 278-289 [PMID:28128562]
ChEMBL Inhibition of HFIP-induced human recombinant amyloid beta (1 to 42 residues) aggregation expressed in Escherichia coli measured over 24 hrs by ThT-based fluorescence spectroscopic method B 5 pIC50 9900 nM IC50 Eur J Med Chem (2017) 126: 823-843 [PMID:27951490]
ChEMBL Inhibition of Abeta42 (unknown origin) aggregation measured after 24 hrs by ThT fluorescence assay B 5.05 pIC50 9000 nM IC50 Bioorg. Med. Chem. Lett. (2016) 26: 3330-3335 [PMID:27256911]
ChEMBL Inhibition of HFIP-pretreated amyloid beta (1 to 42 residues) (unknown origin) aggregation after 24 hrs by ThT fluorescence assay B 5.05 pIC50 9000 nM IC50 Bioorg Med Chem Lett (2017) 27: 1405-1411 [PMID:28216401]
ChEMBL Inhibition of amyloid beta (1 to 42) (unknown origin) self aggregation B 5.19 pIC50 6385 nM IC50 Eur J Med Chem (2019) 180: 656-672 [PMID:31352246]
ChEMBL Inhibition of amyloid beta (1 to 42 residues) (unknown origin) aggregation after 24 hrs by thioflavin T fluorescence assay B 5.27 pIC50 5400 nM IC50 Bioorg Med Chem Lett (2016) 26: 5024-5028 [PMID:27624076]
ChEMBL Inhibition of amyloid beta (1 to 42) fibrillization (unknown origin) incubated with agitation for 1 min every hr measured over 80 hrs by thioflavin-T assay B 5.47 pIC50 3400 nM IC50 Eur J Med Chem (2018) 158: 393-404 [PMID:30227353]
ChEMBL Inhibition of HFIP-induced human recombinant amyloid beta (1 to 40 residues) aggregation expressed in Escherichia coli measured over 24 hrs by ThT-based fluorescence spectroscopic method B 5.48 pIC50 3300 nM IC50 Eur J Med Chem (2017) 126: 823-843 [PMID:27951490]
ChEMBL Inhibition of self-induced amyloid beta 42 (unknown origin) aggregation measured for 24 hrs by thioflavin T-based fluorescence spectroscopic analysis B 5.51 pIC50 3100 nM IC50 ACS Med. Chem. Lett. (2016) 7: 502-507 [PMID:27190601]
ChEMBL Inhibition of self-induced amyloid beta 40 (unknown origin) aggregation measured for 24 hrs by thioflavin T-based fluorescence spectroscopic analysis B 5.82 pIC50 1500 nM IC50 ACS Med. Chem. Lett. (2016) 7: 502-507 [PMID:27190601]
ChEMBL Inhibition of amyloid beta (1 to 40 residues) (unknown origin) fibril formation by thioflavin-T fluorescence based assay B 6 pIC50 1000 nM IC50 J Med Chem (2017) 60: 1620-1637 [PMID:28074653]
ChEMBL Inhibition of human amyloid beta (1 to 40) aggregation after 1 hr by thioflavin-T fluorescence assay B 6.1 pIC50 800 nM IC50 J Nat Prod (2017) 80: 278-289 [PMID:28128562]
ChEMBL Inhibition of amyloid beta (1 to 42) aggregation (unknown origin) by ThT fluorescence assay B 6.2 pIC50 630 nM IC50 Bioorg Med Chem (2017) 25: 1195-1201 [PMID:28043778]
butyrylcholinesterase/Butyrylcholinesterase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1914] [GtoPdb: 2471] [UniProtKB: P06276]
ChEMBL Inhibition of human serum BuChE using butylthiocholine chloride as substrate pretreated for 15 mins followed by substrate addition measured for 2 mins by DTNB reagent based spectrophotometric method B 5.3 pIC50 >5000 nM IC50 Eur J Med Chem (2017) 130: 139-153 [PMID:28242549]
CDGSH iron-sulfur domain-containing protein 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1795168] [UniProtKB: Q9NZ45]
ChEMBL Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichia coli BL21 by Cheng-Prusoff analysis B 7 pKi 101 nM Ki Bioorg Med Chem Lett (2016) 26: 5350-5353 [PMID:27687671]
ChEMBL Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichia coli BL21 by scintillation proximity assay B 5.63 pIC50 2360 nM IC50 Bioorg Med Chem Lett (2016) 26: 5350-5353 [PMID:27687671]
Coagulation factor III in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4081] [UniProtKB: P13726]
ChEMBL Inhibition of LPS-induced tissue factor procoagulant activity in human THP1 cells preincubated for 1 hr followed by LPS addition measured after 5 hrs using factor 10a chromogenic substrate in presence of prothrombin complex B 7.88 pIC50 13.16 nM IC50 Bioorg Med Chem Lett (2017) 27: 1026-1030 [PMID:28109788]
CREB binding protein/CREB-binding protein in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5747] [GtoPdb: 2734] [UniProtKB: Q92793]
ChEMBL Inhibition of recombinant CBP (unknown origin) expressed in baculovirus expression system using histone substrate after 10 mins by liquid scintillation counting method in presence of [3H]acetyl-CoA B 4.6 pIC50 25000 nM IC50 J. Med. Chem. (2016) 59: 1249-1270 [PMID:26701186]
epidermal growth factor receptor/Epidermal growth factor receptor erbB1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL203] [GtoPdb: 1797] [UniProtKB: P00533]
ChEMBL Time-Resolved Fluorescence Assay: The kinase activity of EGFR was detected according to time-resolved fluorescence detection technology to evaluate automatic phosphorylation levels. The test compound was dissolved in 100% DMSO, diluted with 25 mM HEPES (pH=7.4) to the desired concentration, added into each well with 10 μL of the test compounds and 10 μL solution containing 5 ng EGFR, then cultured for 10 min at room temperature using the recombinase diluted by 100 mM HEPES with a dilution ratio of 1:80, subsequently added with 10 μL solution containing 20 mM HEPES, 2 mM MnCl2, 100 μM Na3VO4, 1 mM DTT buffer, and 20 μL of 0.1 mM ATP and 50 mM MgCl2 and cultured for 1 h. The positive group in each plate was added with ATP-MgCl2 enzyme, the negative control group without adding with ATP-MgCl2 enzyme, the liquid was sucked out completely after cultured for 1 h, and each well was washed with buffer for three times. The wells were added with 75 μL anti-phosphorylated tyrosine antibody containing 400 ng europium labeling and cultured 1 h, washed, then added with enhancing solution. At the excitation wavelength 340 nm and the emission wavelength 615 nm, the fluorescence intensities were detected by using Victor type 2 time-resolved luminoscope, wherein the inhibitory rate of the compound on automatic phosphorylation: the inhibitory rate of autophosphorylation=100%−[(negative control)/(positive control−negative control)]. B 5.06 pIC50 8650 nM IC50 US-9409845-B2. Alpha-(3,5-dimethoxybenzylidene)-alpha′-hydrocarbyl methylene cyclic ketone and preparation method thereof (2016)
hydroxysteroid 17-beta dehydrogenase 2/Estradiol 17-beta-dehydrogenase 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2789] [GtoPdb: 3094] [UniProtKB: P37059]
ChEMBL Inhibition of human 17beta-HSD2 expressed in HEK293 cell lysates incubated for 10 mins using [2,4,6,7-3H]-estradiol and NAD+ by scintillation counting method B 5.76 pIC50 1730 nM IC50 J Nat Prod (2017) 80: 965-974 [PMID:28319389]
glycogen synthase kinase 3 beta/Glycogen synthase kinase-3 beta in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL262] [GtoPdb: 2030] [UniProtKB: P49841]
ChEMBL Inhibition of human recombinant GSK3-beta using prephosphorylated polypeptide as substrate incubated for 30 mins by Glo-type luminescence assay B 4.75 pIC50 17950 nM IC50 J. Med. Chem. (2016) 59: 531-544 [PMID:26696252]
glycogen synthase kinase 3 beta/Glycogen synthase kinase-3 beta in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3669] [GtoPdb: 2030] [UniProtKB: P18266]
ChEMBL Inhibition of recombinant rat N-terminal GST-tagged GSK3beta expressed in Escherichia coli assessed as reduction in tau phosphorylation preincubated for 30 mins followed by tau protein addition measured after 1 hr by ELISA B 7.18 pIC50 66 nM IC50 J Med Chem (2017) 60: 1620-1637 [PMID:28074653]
Glyoxalase I in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2424] [UniProtKB: Q04760]
ChEMBL Inhibition of human erythrocyte Glyoxalase-1 using GSH and MGO as substrate by Dixon plot analysis B 8.3 pKi 5 nM Ki Bioorg Med Chem (2020) 28: 115243-115243 [PMID:31879183]
GroEL/GroES in Escherichia coli (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106139] [UniProtKB: Q548M1Q7BGE6]
ChEMBL Inhibition of Escherichia coli GroEL expressed in Escherichia coliDH5alpha/Escherichia coli GroES expressed in Escherichia coli BL21 (DE3) assessed as reduction in GroEL/GroES-mediated denatured soluble pig heart MDH refolding by measuring MDH enzyme activity using sodium mesoxalate as substrate after 20 to 40 mins by malachite green dye based spectrometric analysis B 5.51 pIC50 3100 nM IC50 Bioorg Med Chem Lett (2019) 29: 1106-1112 [PMID:30852084]
ChEMBL Inhibition of Escherichia coli GroEL expressed in Escherichia coli DH5alpha/Escherichia coli GroES expressed in Escherichia coli BL21 (DE3) assessed as reduction in GroEL/GroES-mediated denatured rhodanese refolding by measuring rhodanese enzyme activity after 45 mins by Fe(SCN)3 dye based spectrometric analysis B 5.54 pIC50 2900 nM IC50 Bioorg Med Chem Lett (2019) 29: 1106-1112 [PMID:30852084]
E1A binding protein p300/Histone acetyltransferase p300 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3784] [GtoPdb: 2735] [UniProtKB: Q09472]
GtoPdb - - 4.6 pIC50 25000 nM IC50 J Biol Chem (2004) 279: 51163-71 [PMID:15383533]
ChEMBL Inhibition of recombinant p300 (unknown origin) expressed in baculovirus expression system using histone substrate after 10 mins by liquid scintillation counting method in presence of [3H]acetyl-CoA B 4.6 pIC50 25000 nM IC50 J. Med. Chem. (2016) 59: 1249-1270 [PMID:26701186]
ChEMBL Inhibition of recombinant human full-length His6-tagged p300 expressed in baculovirus infected Sf21 insect cells using [3H]acetylCoA as substrate preincubated for 10 mins followed by substrate addition and measured after 10 mins by liquid scintillation counting method B 4.6 pIC50 25000 nM IC50 J Med Chem (2020) 63: 1337-1360 [PMID:31910017]
ChEMBL Inhibition of recombinant human p300 catalytic domain (1284 to 1673 residues) using histone H3 peptide substrate after 1 hr by liquid scintillation counting method in presence of [3H]acetyl-CoA B 5.19 pIC50 6500 nM IC50 J. Med. Chem. (2016) 59: 1249-1270 [PMID:26701186]
HSP60/HSP10 in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106131] [UniProtKB: P10809P61604]
ChEMBL Inhibition of human N-terminal octa-His-tagged HSP60 expressed in Escherichia coli Rosetta(DE3) pLysS/human HSP10 expressed in Escherichia coli Rosetta(DE3) assessed as reduction in HSP60/HSP10-mediated denatured MDH refolding by measuring MDH enzyme activity using sodium mesoxalate as substrate after 40 to 60 mins by malachite green dye based spectrometric analysis B 5.08 pIC50 8300 nM IC50 Bioorg Med Chem Lett (2019) 29: 1106-1112 [PMID:30852084]
lysine demethylase 1A/Lysine-specific histone demethylase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6136] [GtoPdb: 2669] [UniProtKB: O60341]
ChEMBL Inhibition of human recombinant LSD1 using fluorogenic ADHP as substrate preincubated for 30 mins followed by substrate addition measured after 10 mins by fluorescence assay B 5.02 pIC50 9600 nM IC50 Bioorg Med Chem Lett (2019) 29: 126683-126683 [PMID:31627991]
Microtubule-associated protein tau in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1293224] [UniProtKB: P10636]
ChEMBL Inhibition of tau (unknown origin) fibril formation by fluorescence assay B 4.89 pIC50 13000 nM IC50 J Med Chem (2017) 60: 1620-1637 [PMID:28074653]
ChEMBL Inhibition of tau (unknown origin) fibril formation by thioflavin-T fluorescence based assay B 5.46 pIC50 3500 nM IC50 J Med Chem (2017) 60: 1620-1637 [PMID:28074653]
ChEMBL Inhibition of recombinant human TAU three-repeat microtubule-binding domain aggregation expressed in Escherichia coli after 16 hrs by thioflavin T fluorescence assay B 5.52 pIC50 3000 nM IC50 Bioorg Med Chem Lett (2016) 26: 5024-5028 [PMID:27624076]
Monoamine oxidase A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1951] [GtoPdb: 2489] [UniProtKB: P21397]
ChEMBL Inhibition of recombinant human MAO-A using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate addition measured for 15 mins by amplex red assay B 6.15 pKi 710 nM Ki ACS Med. Chem. Lett. (2016) 7: 56-61 [PMID:26819666]
Monoamine oxidase B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2039] [GtoPdb: 2490] [UniProtKB: P27338]
ChEMBL Inhibition of recombinant human MAO-B using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate addition measured for 15 mins by amplex red assay B 4.67 pKi 21500 nM Ki ACS Med. Chem. Lett. (2016) 7: 56-61 [PMID:26819666]
nuclear factor, erythroid 2 like 2/Nuclear factor erythroid 2-related factor 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075094] [GtoPdb: 3057] [UniProtKB: Q16236]
ChEMBL Activation of Nrf2 (unknown origin) expressed in human HepG2 cells after 5 hrs by ARE-driven luciferase reporter gene assay B 4.68 pEC50 21000 nM EC50 Eur J Med Chem (2018) 143: 854-865 [PMID:29223100]
Plasmodium falciparum 3D7 (target type: ORGANISM) [ChEMBL: CHEMBL2366922]
ChEMBL Antimalarial activity against chloroquine-sensitive Plasmodium falciparum 3D7 after 24 hrs by [3H]hypoxanthine labeling method F 4.6 pIC50 25000 nM IC50 MedChemComm (2016) 7: 214-223
mPGES1/Prostaglandin E synthase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5658] [GtoPdb: 1377] [UniProtKB: O14684]
ChEMBL Inhibition of mPGES1 in human A549 cell microsomal membrane using pGH2 as substrate pretreated for 15 mins followed by substrate addition and measured after 1 min by RP-HPLC method B 6.52 pIC50 300 nM IC50 Eur J Med Chem (2018) 153: 2-28 [PMID:29329790]
ChEMBL Inhibition of mPGES-1 in human IL-1beta-stimulated A549 cell microsomes assessed as reduction of PGE2 formation from PGH2 preincubated for 15 mins by HPLC analysis B 6.66 pIC50 220 nM IC50 J. Nat. Prod. (2015) 78: 2867-2879 [PMID:26588603]
ChEMBL Inhibition of microsomal PGES1 in ILbeta-stimulated human A549 cells using PGH2 as substrate preincubated for 15 mins followed by substrate addition measured after 1 min by RP-HPLC analysis B 6.7 pIC50 200 nM IC50 MedChemComm (2015) 6: 2081-2123
proteasome 20S subunit beta 5/Proteasome Macropain subunit MB1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4662] [GtoPdb: 2406] [UniProtKB: P28074]
ChEMBL Inhibition of chymotrypsin-like activity of human 26S proteasome in human HCT-116 cells assessed as decrease in AMC hydrolysis using Suc-LLVY-AMC as substrate preincubated for 24 hrs followed by addition of substrate and measured after 2 hrs by fluorometric analysis B 5 pIC50 10000 nM IC50 Eur J Med Chem (2019) 167: 291-311 [PMID:30776692]
ChEMBL Inhibition of chymotrypsin-like activity of human 26S proteasome in human SW480 cells assessed as decrease in AMC hydrolysis using Suc-LLVY-AMC as substrate preincubated for 24 hrs followed by addition of substrate and measured after 2 hrs by fluorometric analysis B 5 pIC50 10000 nM IC50 Eur J Med Chem (2019) 167: 291-311 [PMID:30776692]
Sarcoplasmic/endoplasmic reticulum calcium ATP-ase in Rabbit (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4693] [UniProtKB: P04191]
ChEMBL Inhibition of rabbit SERCA1b expressed in COS7 cells microsomal membranes preincubated for 10 mins followed by addition of ATP and measured after 40 mins by ELISA method B 5.24 pKi 5800 nM Ki J Med Chem (2020) 63: 1937-1963 [PMID:32030976]
ChEMBL Inhibition of rabbit skeletal muscle microsomes SERCA1a by enzyme-coupled method B 5.52 pIC50 3000 nM IC50 J Med Chem (2020) 63: 1937-1963 [PMID:32030976]
SERCA2/Sarcoplasmic/endoplasmic reticulum calcium ATPase 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3901] [GtoPdb: 841] [UniProtKB: P16615]
ChEMBL Inhibition of human SERCA2b expressed in COS7 cells microsomal membranes preincubated for 10 mins followed by addition of ATP and measured after 40 mins by ELISA method B 4.28 pKi 53000 nM Ki J Med Chem (2020) 63: 1937-1963 [PMID:32030976]
ChEMBL Inhibition of SERCA2b in human platelet microsomes by enzyme-coupled method B 5.15 pIC50 7000 nM IC50 J Med Chem (2020) 63: 1937-1963 [PMID:32030976]
SERCA3/Sarcoplasmic/endoplasmic reticulum calcium ATPase 3 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2401] [GtoPdb: 842] [UniProtKB: Q93084]
ChEMBL Inhibition of human SERCA3a expressed in COS7 cells microsomal membranes preincubated for 10 mins followed by addition of ATP and measured after 40 mins by ELISA method B 5.07 pKi 8600 nM Ki J Med Chem (2020) 63: 1937-1963 [PMID:32030976]
ChEMBL Inhibition of SERCA3 in human platelet microsomes by enzyme-coupled method B 5.15 pIC50 7000 nM IC50 J Med Chem (2020) 63: 1937-1963 [PMID:32030976]
p21 (RAC1) activated kinase 1/Serine/threonine-protein kinase PAK 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4600] [GtoPdb: 2133] [UniProtKB: Q13153]
ChEMBL Inhibition of recombinant human PAK1 by ADP-Glo kinase assay B 4.8 pIC50 16000 nM IC50 Eur J Med Chem (2017) 142: 229-243 [PMID:28814374]
Sortase A in Streptococcus mutans (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4523939] [UniProtKB: Q8CM62]
ChEMBL Binding affinity to Streptococcus mutans Sortase A B 4.99 pIC50 10200 nM IC50 MedChemComm (2019) 10: 1057-1067
SRC proto-oncogene, non-receptor tyrosine kinase/Tyrosine-protein kinase SRC in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3074] [GtoPdb: 2206] [UniProtKB: P05480]
ChEMBL Inhibition of Src in mouse BV2 cells assessed as suppression of LPS-induced NO release preincubated for 1 hr followed by LPS addition measured after 24 hrs by Griess assay B 5.66 pIC50 2200 nM IC50 J Med Chem (2016) 59: 9062-9079 [PMID:27617803]

ChEMBL data shown on this page come from version 28:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, Cibrián-Uhalte E, Davies M, Dedman N, Karlsson A, Magariños MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]