Click here for a description of the charts and data table
Please tell us if you are using this feature and what you think!
ChEMBL ligand: CHEMBL284616 (5-cqa, Chlorogenic acid, Cp chlorogenic acid, Heriguard, NSC-407296, NSC-70861, Trans-5-o-caffeoylquinic acid, Trans-caffeic acid 5-o-d-quinate, Trans-chlorogenic acid) |
---|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
---|---|---|---|---|---|---|---|---|
Aldo-keto reductase family 1 member B10 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5983] [UniProtKB: O60218] | ||||||||
ChEMBL | Inhibition of human recombinant N-terminus His6-tagged AKR1B10 expressed in Escherichia coli BL21 DE3 assessed as pyridine-3-aldehyde reduction by spectrometric analysis | B | 5.1 | pIC50 | 7900 | nM | IC50 | Eur J Med Chem (2012) 48: 321-329 [PMID:22236472] |
aldo-keto reductase family 1 member B/Aldose reductase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1900] [GtoPdb: 2768] [UniProtKB: P15121] | ||||||||
ChEMBL | Inhibition of human recombinant aldose reductase using D-glyceraldehyde as substrate preincubated for 10 mins before substrate addition measured for every 10 secs for 50 mins by spectrophotometry | B | 5.74 | pIC50 | 1800 | nM | IC50 | Bioorg Med Chem (2012) 20: 1251-1258 [PMID:22261024] |
ChEMBL | Inhibition of human recombinant N-terminus His6-tagged AKR1B1 expressed in Escherichia coli BL21 DE3 assessed as pyridine-3-aldehyde reduction by spectrometric analysis | B | 6.52 | pIC50 | 300 | nM | IC50 | Eur J Med Chem (2012) 48: 321-329 [PMID:22236472] |
aldo-keto reductase family 1 member B/Aldose reductase in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2622] [GtoPdb: 2768] [UniProtKB: P07943] | ||||||||
ChEMBL | Inhibition of Sprague-Dawley rat lens aldose reductase | B | 6.02 | pIC50 | 950 | nM | IC50 | J Nat Prod (2012) 75: 267-270 [PMID:22264115] |
Amyloid-beta A4 protein in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2487] [UniProtKB: P05067] | ||||||||
ChEMBL | Inhibition of human amyloid beta (1 to 42) aggregation after 24 hrs by thioflavin-T fluorescence assay | B | 4.03 | pIC50 | 92900 | nM | IC50 | Bioorg Med Chem (2012) 20: 5844-5849 [PMID:22921742] |
Beta-1,3-glucan synthase in Candida albicans (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2037] [UniProtKB: O13383] | ||||||||
ChEMBL | Inhibition of Candida albicans 1,3 beta-D-glucan synthase | B | 4.05 | pIC50 | >90000 | nM | IC50 | Bioorg Med Chem (2010) 18: 7009-7014 [PMID:20813534] |
Human immunodeficiency virus type 1 integrase in Human immunodeficiency virus 1 (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3471] [UniProtKB: Q7ZJM1] | ||||||||
ChEMBL | Inhibition of HIV-1 integrase, under 1 uM for the 3''-preprocessing | B | 4.06 | pIC50 | 87800 | nM | IC50 | J Med Chem (2000) 43: 2100-2114 [PMID:10841789] |
ChEMBL | Inhibitory concentration of compound against 3'-processing of HIV-1 integrase in experiment 1 | B | 4.06 | pIC50 | 87800 | nM | IC50 | J Med Chem (1997) 40: 942-951 [PMID:9083483] |
ChEMBL | Inhibitory concentration of compound against 3'-processing of HIV-1 integrase in experiment 2 | B | 4.24 | pIC50 | 58200 | nM | IC50 | J Med Chem (1997) 40: 942-951 [PMID:9083483] |
ChEMBL | Tested for inhibition of HIV-1 integrase, under 1 uM for the strand transfer | B | 4.34 | pIC50 | 45800 | nM | IC50 | J Med Chem (2000) 43: 2100-2114 [PMID:10841789] |
ChEMBL | Inhibitory concentration of compound against strand transfer of HIV-1 integrase in experiment 1 | B | 4.34 | pIC50 | 45800 | nM | IC50 | J Med Chem (1997) 40: 942-951 [PMID:9083483] |
ChEMBL | Inhibitory concentration of compound against strand transfer of HIV-1 integrase in experiment 2 | B | 4.5 | pIC50 | 31300 | nM | IC50 | J Med Chem (1997) 40: 942-951 [PMID:9083483] |
protein tyrosine phosphatase non-receptor type 1/Protein-tyrosine phosphatase 1B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL335] [GtoPdb: 2976] [UniProtKB: P18031] | ||||||||
ChEMBL | Non-competitive inhibition of PTP1B (unknown origin) using p-NPP as substrate by Lineweaver-Burk plot analysis | B | 4.82 | pKi | 15100 | nM | Ki | Bioorg Med Chem Lett (2018) 28: 1194-1197 [PMID:29525218] |
ChEMBL | Inhibition of PTP1B (unknown origin) | B | 4.95 | pIC50 | 11100 | nM | IC50 | Bioorg Med Chem Lett (2018) 28: 1194-1197 [PMID:29525218] |
GtoPdb | - | - | 4.96 | pIC50 | 11000 | nM | IC50 | Bioorg Med Chem (2021) 44: 116295 [PMID:34246920] |
ChEMBL | Inhibition of PTP1B (unknown origin) | B | 7 | pIC50 | 100 | nM | IC50 | Bioorg Med Chem (2021) 44: 116295-116295 [PMID:34246920] |
Sortase A in S.aureus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5362] [UniProtKB: Q9S446] | ||||||||
ChEMBL | Inhibition of Staphylococcus aureus SrtA using EDANS-Dabcyl as substrate by FRET assay | B | 4.02 | pIC50 | 95600 | nM | IC50 | J Med Chem (2021) 64: 13097-13130 [PMID:34516107] |
protein tyrosine phosphatase non-receptor type 2/T-cell protein-tyrosine phosphatase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3807] [GtoPdb: 3255] [UniProtKB: P17706] | ||||||||
ChEMBL | Inhibition of TCPTP (unknown origin) | B | 4.11 | pIC50 | 77900 | nM | IC50 | Bioorg Med Chem Lett (2018) 28: 1194-1197 [PMID:29525218] |
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]