daidzein [Ligand Id: 2828] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL8145 (4',7-dihydroxyisoflavone, Daidzein) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| Alcohol sulfotransferase in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3007] [UniProtKB: P15709] | ||||||||
| ChEMBL | Inhibition of rat SULT2A1-mediated dehydroepiandrosterone sulfonation incubated for 20 mins | B | 4.47 | pIC50 | 34000 | nM | IC50 | Eur J Med Chem (2021) 213: 113037-113037 [PMID:33257172] |
| aldehyde dehydrogenase 2 family member/Aldehyde dehydrogenase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1935] [GtoPdb: 2595] [UniProtKB: P05091] | ||||||||
| ChEMBL | Inhibition of Hamster Liver mitochondrial ALDH-2 | B | 5.05 | pIC50 | 9000 | nM | IC50 | J Med Chem (2000) 43: 4169-4179 [PMID:11063613] |
| ChEMBL | Inhibition of hamster liver aldehyde dehydrogenase ALDH-2 | B | 5.05 | pIC50 | 9000 | nM | IC50 | J Med Chem (2001) 44: 3320-3328 [PMID:11563931] |
| Aldo-keto reductase family 1 member B10 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5983] [UniProtKB: O60218] | ||||||||
| ChEMBL | Inhibition of recombinant human N-terminal His6-tagged AKR1B10 expressed in Escherichia coli BL21 cells using all-trans-retinal as substrate incubated for 15 mins by HPLC method | B | 4.49 | pIC50 | 32200 | nM | IC50 | J Nat Prod (2015) 78: 2666-2674 [PMID:26529431] |
| Alpha-glucosidase MAL62 in Saccharomyces cerevisiae (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4357] [UniProtKB: P07265] | ||||||||
| ChEMBL | Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry | B | 1.15 | pIC50 | 1.15 | - | logIC50 | Med Chem Res (2012) 21: 3984-3993 |
| Aryl sulfotransferase in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4886] [UniProtKB: P17988] | ||||||||
| ChEMBL | Inhibition of rat liver SULT1A1-mediated oestradiol sulfonation incubated for 20 mins | B | 6.54 | pIC50 | 290 | nM | IC50 | Eur J Med Chem (2021) 213: 113037-113037 [PMID:33257172] |
| carbonic anhydrase 1/Carbonic anhydrase I in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL261] [GtoPdb: 2597] [UniProtKB: P00915] | ||||||||
| ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 preincubated for 15 mins at room temperature/6 hrs at 4 deg C by stopped-flow CO2 hydration assay | B | 5 | pKi | >10000 | nM | Ki | Bioorg Med Chem (2015) 23: 7219-7225 [PMID:26498393] |
| carbonic anhydrase 2/Carbonic anhydrase II in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL205] [GtoPdb: 3092] [UniProtKB: P00918] | ||||||||
| ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 preincubated for 15 mins at room temperature/6 hrs at 4 deg C by stopped-flow CO2 hydration assay | B | 5 | pKi | >10000 | nM | Ki | Bioorg Med Chem (2015) 23: 7219-7225 [PMID:26498393] |
| carbonic anhydrase 4/Carbonic anhydrase IV in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3729] [GtoPdb: 2599] [UniProtKB: P22748] | ||||||||
| ChEMBL | Inhibition of human recombinant carbonic anhydrase 4 preincubated for 15 mins at room temperature/6 hrs at 4 deg C by stopped-flow CO2 hydration assay | B | 6.14 | pKi | 718.7 | nM | Ki | Bioorg Med Chem (2015) 23: 7219-7225 [PMID:26498393] |
| carbonic anhydrase 7/Carbonic anhydrase VII in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2326] [GtoPdb: 2749] [UniProtKB: P43166] | ||||||||
| ChEMBL | Inhibition of human recombinant carbonic anhydrase 7 preincubated for 15 mins at room temperature/6 hrs at 4 deg C by stopped-flow CO2 hydration assay | B | 8.38 | pKi | 4.2 | nM | Ki | Bioorg Med Chem (2015) 23: 7219-7225 [PMID:26498393] |
| carbonic anhydrase 12/Carbonic anhydrase XII in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3242] [GtoPdb: 2747] [UniProtKB: O43570] | ||||||||
| ChEMBL | Inhibition of human recombinant carbonic anhydrase 12 preincubated for 15 mins at room temperature/6 hrs at 4 deg C by stopped-flow CO2 hydration assay | B | 7.25 | pKi | 56.4 | nM | Ki | Bioorg Med Chem (2015) 23: 7219-7225 [PMID:26498393] |
| CYP19A1/Cytochrome P450 19A1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1978] [GtoPdb: 1362] [UniProtKB: P11511] | ||||||||
| ChEMBL | Inhibition of human aromatase expressed in CHO cells | B | 4 | pKi | 100000 | nM | Ki | Bioorg Med Chem (2008) 16: 8466-8470 [PMID:18778944] |
| Estrogen receptor-α/Estrogen receptor alpha in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL206] [GtoPdb: 620] [UniProtKB: P03372] | ||||||||
| ChEMBL | Inhibition of binding of 17 beta-estradiol to human Estrogen receptor alpha | B | 5.74 | pKi | 1800 | nM | Ki | Bioorg Med Chem Lett (2001) 11: 1839-1842 [PMID:11459643] |
| ChEMBL | Displacement of EL red from human full-length ER-alpha expressed in baculovirus expression system incubated for 2 hrs by fluorescence polarization assay | B | 4.57 | pIC50 | 26650 | nM | IC50 | Eur J Med Chem (2022) 241: 114658-114658 [PMID:35964426] |
| ChEMBL | Displacement of [3H]estradiol from human recombinant ERalpha | B | 4.77 | pIC50 | 17000 | nM | IC50 | J Nat Prod (2002) 65: 1749-1753 [PMID:12502307] |
| ChEMBL | Inhibition of binding of 17 beta-estradiol to human Estrogen receptor alpha | B | 5.2 | pIC50 | 6300 | nM | IC50 | Bioorg Med Chem Lett (2001) 11: 1839-1842 [PMID:11459643] |
| ChEMBL | Binding affinity against human estrogen receptor alpha in competitive binding assay | B | 5.67 | pIC50 | 2160 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 1417-1421 [PMID:15006374] |
| ChEMBL | Displacement of fluorescent labeled ES2 from recombinant ERalpha | B | 6.35 | pIC50 | 450 | nM | IC50 | J Med Chem (2010) 53: 6153-6163 [PMID:20669983] |
| Estrogen receptor-β/Estrogen receptor beta in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL242] [GtoPdb: 621] [UniProtKB: Q92731] | ||||||||
| ChEMBL | Inhibition of binding of 17 beta-estradiol to human Estrogen receptor beta | B | 6.52 | pKi | 300 | nM | Ki | Bioorg Med Chem Lett (2001) 11: 1839-1842 [PMID:11459643] |
| ChEMBL | Binding affinity for human Estrogen receptor beta | B | 5.55 | pIC50 | 2800 | nM | IC50 | J Med Chem (2005) 48: 3463-3466 [PMID:15887952] |
| ChEMBL | Binding affinity for human Estrogen receptor beta | B | 5.55 | pIC50 | 2800 | nM | IC50 | J Med Chem (2005) 48: 3463-3466 [PMID:15887952] |
| ChEMBL | Binding Assay: The binding affinity and selectivity of candidate molecules yielded from database screening were determined by a fluorescent polarization competitive binding assay using purified baculovirus-expressed human ER beta or ER alpha and a fluorescent estrogen ligand EL Red (PanVera Corp.). | B | 5.55 | pIC50 | 2800 | nM | IC50 | US-8552057-B2. Phytoestrogenic formulations for alleviation or prevention of neurodegenerative diseases (2013) |
| ChEMBL | Displacement of EL red from human full-length ER-beta expressed in baculovirus expression system incubated for 2 hrs by fluorescence polarization assay | B | 5.76 | pIC50 | 1738 | nM | IC50 | Eur J Med Chem (2022) 241: 114658-114658 [PMID:35964426] |
| ChEMBL | Displacement of [3H]estradiol from human recombinant ERbeta | B | 5.92 | pIC50 | 1200 | nM | IC50 | J Nat Prod (2002) 65: 1749-1753 [PMID:12502307] |
| ChEMBL | Inhibition of binding of 17 beta-estradiol to human Estrogen receptor beta | B | 5.96 | pIC50 | 1100 | nM | IC50 | Bioorg Med Chem Lett (2001) 11: 1839-1842 [PMID:11459643] |
| ChEMBL | Binding affinity against human estrogen receptor beta (ER beta) in competitive binding assay | B | 6.52 | pIC50 | 303 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 1417-1421 [PMID:15006374] |
| Fatty acid synthase in Plasmodium falciparum (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4512] [UniProtKB: Q965D7] | ||||||||
| ChEMBL | Inhibition of FabZ | B | 4.52 | pIC50 | 30000 | nM | IC50 | J Med Chem (2006) 49: 3345-3353 [PMID:16722653] |
| histone deacetylase 6/Histone deacetylase 6 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1865] [GtoPdb: 2618] [UniProtKB: Q9UBN7] | ||||||||
| ChEMBL | Determination of IC50 values for inhibition of enzymatic assay of human HDAC6 with custom peptide substrate | B | 6.04 | pIC50 | 917.1 | nM | IC50 | HDAC6 screening dataset using tau-based substrate in an enzymatic assay yields selective inhibitors and activators |
| Neuraminidase in Influenza A virus (A/Puerto Rico/8/1934(H1N1)) (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2051] [UniProtKB: P03468] | ||||||||
| ChEMBL | Inhibition of Influenza A PR/8/34 H1N1 virus neuraminidase activity by MUN-ANA substrate based fluorimetric assay | B | 0.97 | pIC50 | 0.97 | - | logIC50 | Eur J Med Chem (2010) 45: 1724-1730 [PMID:20116898] |
| Neuraminidase in Influenza A virus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6135] [UniProtKB: B4URF0] | ||||||||
| ChEMBL | Inhibition of Influenza A Jiangsu/10/2003 virus neuraminidase activity by MUN-ANA substrate based fluorimetric assay | B | 4.33 | pIC50 | 46800 | nM | IC50 | Bioorg Med Chem (2008) 16: 7141-7147 [PMID:18640042] |
| ChEMBL | Inhibition of Influenza A PR/8/34 H1N1 virus neuraminidase activity by MUN-ANA substrate based fluorimetric assay | B | 4.43 | pIC50 | 37100 | nM | IC50 | Bioorg Med Chem (2008) 16: 7141-7147 [PMID:18640042] |
| ChEMBL | Inhibition of Influenza A Jinan/15/90 H3N2 virus neuraminidase activity by MUN-ANA substrate based fluorimetric assay | B | 4.58 | pIC50 | 26600 | nM | IC50 | Bioorg Med Chem (2008) 16: 7141-7147 [PMID:18640042] |
| 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 purified human erythrocyte 20S proteasome assessed as decrease in AMC hydrolysis using Suc-LLVY-AMC as substrate preincubated for 10 mins and measured by fluorescence based method | B | 4 | pIC50 | >100000 | nM | IC50 | Eur J Med Chem (2019) 167: 291-311 [PMID:30776692] |
| transthyretin/Transthyretin in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3194] [GtoPdb: 2851] [UniProtKB: P02766] | ||||||||
| ChEMBL | Inhibition of transthyretin V30M mutant (unknown origin) expressed in Escherichia coli assessed as inhibition of sodium acetate-mediated aggregation preincubated for 30 mins followed by sodium acetate addition measured after 96 hrs by thioflavin T assay | B | 4.8 | pIC50 | 16000 | nM | IC50 | J Med Chem (2014) 57: 1090-1096 [PMID:24422526] |
| Cav1.2/Voltage-gated L-type calcium channel alpha-1C subunit in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3762] [GtoPdb: 529] [UniProtKB: P22002] | ||||||||
| ChEMBL | Inhibition of L-type calcium channel measured using whole-cell patch clamp in rat ventricular myocytes | F | 4.92 | pIC50 | 12000 | nM | IC50 | J Appl Toxicol (2012) 32: 858-866 [PMID:22761000] |
| ChEMBL | Inhibition of Cav1.2 calcium current measured using whole cell patch clamp in rat ventricular myocytes | F | 4.92 | pIC50 | 12000 | nM | IC50 | IC50 data for the L-type calcium channel extracted from a set of literature articles |
ChEMBL data shown on this page come from version 34:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]
