chlorogenic acid [Ligand Id: 12477] activity data from GtoPdb and ChEMBL

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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)
  • Aldo-keto reductase family 1 member B10 in Human [ChEMBL: CHEMBL5983] [UniProtKB: O60218]
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  • aldo-keto reductase family 1 member B/Aldose reductase in Human [ChEMBL: CHEMBL1900] [GtoPdb: 2768] [UniProtKB: P15121]
  • aldo-keto reductase family 1 member B/Aldose reductase in Rat [ChEMBL: CHEMBL2622] [GtoPdb: 2768] [UniProtKB: P07943]
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  • Beta-1,3-glucan synthase in Candida albicans [ChEMBL: CHEMBL2037] [UniProtKB: O13383]
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  • Human immunodeficiency virus type 1 integrase in Human immunodeficiency virus 1 [ChEMBL: CHEMBL3471] [UniProtKB: Q7ZJM1]
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  • protein tyrosine phosphatase non-receptor type 1/Protein-tyrosine phosphatase 1B in Human [ChEMBL: CHEMBL335] [GtoPdb: 2976] [UniProtKB: P18031]
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  • protein tyrosine phosphatase non-receptor type 2/T-cell protein-tyrosine phosphatase in Human [ChEMBL: CHEMBL3807] [GtoPdb: 3255] [UniProtKB: P17706]
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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]