Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'G-protein coupled bile acid receptor 1' and Ligand = 'BDBM50161836'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
G-protein coupled bile acid receptor 1 (Homo sapiens (Human))	BDBM50161836 (CHEMBL3793012) Show SMILES COc1ccc(cc1OC)C(C)(C)c1cnc(SCCOc2ccc(cc2)C#N)n1-c1ccc(F)cc1 Show InChI InChI=1S/C29H28FN3O3S/c1-29(2,21-7-14-25(34-3)26(17-21)35-4)27-19-32-28(33(27)23-10-8-22(30)9-11-23)37-16-15-36-24-12-5-20(18-31)6-13-24/h5-14,17,19H,15-16H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.30	n/a	n/a	n/a	n/a
Zydus Research Centre Curated by ChEMBL					Assay Description Agonist activity at human TGR5 expressed in CHO-K1 cells after 5 hrs by luciferase reporter gene assay				ACS Med Chem Lett 7: 51-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00323 BindingDB Entry DOI: 10.7270/Q2125VJ1
					More data for this Ligand-Target Pair