baicalin [Ligand Id: 13076] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL485818 (Baicalin)
  • ABCC2/Canalicular multispecific organic anion transporter 1 in Rat [ChEMBL: CHEMBL2073676] [GtoPdb: 780] [UniProtKB: Q63120]
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  • lysine demethylase 1A/Lysine-specific histone demethylase 1 in Human [ChEMBL: CHEMBL6136] [GtoPdb: 2669] [UniProtKB: O60341]
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  • prolyl endopeptidase/Prolyl endopeptidase in Human [ChEMBL: CHEMBL3202] [GtoPdb: 2395] [UniProtKB: P48147]
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  • Cyclic GMP-AMP synthase in Human [GtoPdb: 3165] [UniProtKB: Q8N884]
  • Cyclic GMP-AMP synthase in Mouse [GtoPdb: 3165] [UniProtKB: Q8C6L5]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
ABCC2/Canalicular multispecific organic anion transporter 1 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2073676] [GtoPdb: 780] [UniProtKB: Q63120]
ChEMBL TP_TRANSPORTER: inhibition of DNP-SG uptake in bile canalicular membrane vesicles from SD rat F 5.1 pKi 7950 nM Ki Drug Metabol Pharmacokin (2002) 17: 23-33 [PMID:15618649]
cyclin dependent kinase 1/Cyclin-dependent kinase 1/cyclin B1 in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL1907602] [GtoPdb: 1961] [UniProtKB: P06493P14635]
ChEMBL Inhibition of Cdk1/cyclin B B 4.84 pIC50 14360 nM IC50 Bioorg Med Chem (2008) 16: 7128-7133 [PMID:18639462]
GABAA receptor π subunit/GABAA receptor δ subunit/GABAA receptor α1 subunit/GABAA receptor β1 subunit/GABAA receptor γ2 subunit/GABAA receptor β3 subunit/GABAA receptor α5 subunit/GABAA receptor α3 subunit/GABAA receptor α2 subunit/GABAA receptor β2 subunit/GABAA receptor α4 subunit/GABAA receptor ε subunit/GABAA receptor α6 subunit/GABAA receptor γ1 subunit/GABAA receptor γ3 subunit/GABAA receptor θ subunit/GABA-A receptor; anion channel in Human (target type: PROTEIN COMPLEX GROUP) [ChEMBL: CHEMBL2093872] [GtoPdb: 419416404410414412408406405411407417409413415418] [UniProtKB: O00591O14764P14867P18505P18507P28472P31644P34903P47869P47870P48169P78334Q16445Q8N1C3Q99928Q9UN88]
ChEMBL Binding affinity towards benzodiazepine site in GABAA receptor B 4.11 pKi 77624.71 nM Ki J Med Chem (2001) 44: 1883-1891 [PMID:11384234]
lysine demethylase 1A/Lysine-specific histone demethylase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6136] [GtoPdb: 2669] [UniProtKB: O60341]
ChEMBL Inhibition of LSD1 (unknown origin) B 5.45 pIC50 3550 nM IC50 Bioorg Med Chem (2019) 27: 370-374 [PMID:30552007]
ChEMBL Inhibition of LSD1 (unknown origin) expressed in human MGC-803 cells incubated for 5 days by DAPI staining based immunofluorescence method B 5.52 pIC50 3010 nM IC50 RSC Med Chem (2020) 11: 969-981 [PMID:33479691]
ChEMBL Inhibition of LSD1 (unknown origin) B 5.52 pIC50 3010 nM IC50 Eur J Med Chem (2021) 220: 113501-113501 [PMID:33945992]
prolyl endopeptidase/Prolyl endopeptidase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3202] [GtoPdb: 2395] [UniProtKB: P48147]
ChEMBL Inhibition of human recombinant POP B 4.91 pIC50 12300 nM IC50 J Med Chem (2010) 53: 3423-3438 [PMID:20058865]
ChEMBL Inhibition of human brain prolyl oligopeptidase expressed in Escherichia coli B 4.92 pIC50 12000 nM IC50 Bioorg Med Chem (2008) 16: 7516-7524 [PMID:18650094]
Cyclic GMP-AMP synthase in Human [GtoPdb: 3165] [UniProtKB: Q8N884]
GtoPdb - - 5.4 pIC50 3970 nM IC50 Bioorg Chem (2023) 140: 106802 [PMID:37666112]
Cyclic GMP-AMP synthase in Mouse [GtoPdb: 3165] [UniProtKB: Q8C6L5]
GtoPdb - - 4.96 pIC50 10840 nM IC50 Bioorg Chem (2023) 140: 106802 [PMID:37666112]

ChEMBL data shown on this page come from version 33:

Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
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]