Isochlorogenic acid B [Ligand Id: 12549] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL249448 (3,4-Dicaffeoylquinic Acid, Rel-3,4-Dicaffeoylquinic Acid)
  • acetylcholinesterase (Yt blood group)/Acetylcholinesterase in Human [ChEMBL: CHEMBL220] [GtoPdb: 2465] [UniProtKB: P22303]
Created with Highcharts 10.3.3ValuesChart context menuAcetylcholinesterasepKd HumanpKi HumanpIC50 HumanpEC50 Human0123456Highcharts.com
  • Aldo-keto reductase family 1 member B10 in Human [ChEMBL: CHEMBL5983] [UniProtKB: O60218]
Created with Highcharts 10.3.3ValuesChart context menuAldo-keto reductase family 1 member B10pKd HumanpKi HumanpIC50 HumanpEC50 Human02468Highcharts.com
  • aldo-keto reductase family 1 member B/Aldose reductase in Human [ChEMBL: CHEMBL1900] [GtoPdb: 2768] [UniProtKB: P15121]
Created with Highcharts 10.3.3ValuesChart context menuAldose reductasepKd HumanpKi HumanpIC50 HumanpEC50 Human02468Highcharts.com
Created with Highcharts 10.3.3ValuesChart context menuAmyloid-beta A4 proteinpKd HumanpKi HumanpIC50 HumanpEC50 Human0123456Highcharts.com
  • beta-secretase 1/Beta-secretase 1 in Human [ChEMBL: CHEMBL4822] [GtoPdb: 2330] [UniProtKB: P56817]
Created with Highcharts 10.3.3ValuesChart context menuBeta-secretase 1pKd HumanpKi HumanpIC50 HumanpEC50 Human0123456Highcharts.com
  • protein tyrosine phosphatase non-receptor type 1/Protein-tyrosine phosphatase 1B in Human [ChEMBL: CHEMBL335] [GtoPdb: 2976] [UniProtKB: P18031]
Created with Highcharts 10.3.3ValuesChart context menuProtein-tyrosine phosphatase 1BpKd HumanpKi HumanpIC50 HumanpEC50 Human012345Highcharts.com
  • TRPV3 in Human [GtoPdb: 509] [UniProtKB: Q8NET8]
Created with Highcharts 10.3.3ValuesChart context menuTRPV3pKd HumanpKi HumanpIC50 HumanpEC50 Human01234567Highcharts.com
DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
acetylcholinesterase (Yt blood group)/Acetylcholinesterase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL220] [GtoPdb: 2465] [UniProtKB: P22303]
ChEMBL Inhibition of AChE (unknown origin) B 5.67 pIC50 2140 nM IC50 Eur J Med Chem (2021) 221: 113492-113492 [PMID:33984802]
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 6.62 pIC50 240 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 N-terminus His6-tagged AKR1B1 expressed in Escherichia coli BL21 DE3 assessed as pyridine-3-aldehyde reduction by spectrometric analysis B 7.11 pIC50 78 nM IC50 Eur J Med Chem (2012) 48: 321-329 [PMID:22236472]
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 5.33 pIC50 4700 nM IC50 Bioorg Med Chem (2012) 20: 5844-5849 [PMID:22921742]
beta-secretase 1/Beta-secretase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4822] [GtoPdb: 2330] [UniProtKB: P56817]
ChEMBL Inhibition of BACE1 (unknown origin) B 5.48 pIC50 3310 nM IC50 Eur J Med Chem (2021) 221: 113492-113492 [PMID:33984802]
protein tyrosine phosphatase non-receptor type 1/Protein-tyrosine phosphatase 1B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL335] [GtoPdb: 2976] [UniProtKB: P18031]
ChEMBL Inhibition of PTP1B (unknown origin) B 4.38 pIC50 41500 nM IC50 Bioorg Med Chem Lett (2018) 28: 1194-1197 [PMID:29525218]
TRPV3 in Human [GtoPdb: 509] [UniProtKB: Q8NET8]
GtoPdb - - 6.05 pIC50 900 nM IC50 Acta Pharm Sin B (2022) 12: 723-734 [PMID:35256942]

ChEMBL data shown on this page come from version 35:

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]