Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Bile acid receptor' and Ligand = 'BDBM50028465'   

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
Bile acid receptor (Homo sapiens (Human))	BDBM50028465 (CHEMBL3335657) Show SMILES COc1ccc(cc1NC(=O)c1ccccc1NC(=O)c1ccc(cc1)C(C)(C)C)C(O)=O Show InChI InChI=1S/C26H26N2O5/c1-26(2,3)18-12-9-16(10-13-18)23(29)27-20-8-6-5-7-19(20)24(30)28-21-15-17(25(31)32)11-14-22(21)33-4/h5-15H,1-4H3,(H,27,29)(H,28,30)(H,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a
Goethe University Frankfurt Curated by ChEMBL					Assay Description Transactivation of human FXR expressed in human HeLa cells incubated for 24 hrs by luciferase reporter gene assay				Bioorg Med Chem 23: 499-514 (2015) Article DOI: 10.1016/j.bmc.2014.12.013 BindingDB Entry DOI: 10.7270/Q2MW2JW6
					More data for this Ligand-Target Pair
Bile acid receptor (Homo sapiens (Human))	BDBM50028465 (CHEMBL3335657) Show SMILES COc1ccc(cc1NC(=O)c1ccccc1NC(=O)c1ccc(cc1)C(C)(C)C)C(O)=O Show InChI InChI=1S/C26H26N2O5/c1-26(2,3)18-12-9-16(10-13-18)23(29)27-20-8-6-5-7-19(20)24(30)28-21-15-17(25(31)32)11-14-22(21)33-4/h5-15H,1-4H3,(H,27,29)(H,28,30)(H,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a
Goethe University Frankfurt Curated by ChEMBL					Assay Description Agonist activity at human FXR expressed in human HeLa cells assessed as receptor activation by BSEP promoter-driven firefly luciferase reporter gene ...				J Med Chem 57: 8035-55 (2014) Article DOI: 10.1021/jm500937v BindingDB Entry DOI: 10.7270/Q26H4K06
					More data for this Ligand-Target Pair