Identical Ligands in BindingDB

Found 2 hits Enzyme Inhibition Constant Data   

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   (228/230 > 99%)† (Homo sapiens (Human))	BDBM50297952 (3-[(5-{[3-(2,6-dichlorophenyl)-5-(1-methylethyl)is...) Show SMILES CC(C)c1onc(c1COc1ccc2n(Cc3cccc(c3)C(O)=O)ccc2c1)-c1c(Cl)cccc1Cl |(15.25,-10.29,;15.64,-11.78,;14.53,-12.85,;17.12,-12.21,;18.35,-11.29,;19.6,-12.19,;19.14,-13.66,;17.6,-13.67,;16.84,-15,;15.3,-15.01,;14.53,-16.35,;12.99,-16.35,;12.23,-17.69,;13.01,-19.03,;12.56,-20.49,;11.21,-21.25,;9.89,-20.45,;8.55,-21.2,;7.22,-20.41,;7.25,-18.86,;8.6,-18.12,;9.92,-18.91,;8.62,-16.57,;7.3,-15.78,;9.97,-15.83,;13.81,-21.39,;15.04,-20.47,;14.55,-19.01,;15.31,-17.67,;19.94,-14.96,;21.47,-14.92,;22.2,-13.58,;22.27,-16.23,;21.54,-17.6,;20,-17.63,;19.19,-16.32,;17.65,-16.35,)| Show InChI InChI=1S/C29H24Cl2N2O4/c1-17(2)28-22(27(32-37-28)26-23(30)7-4-8-24(26)31)16-36-21-9-10-25-19(14-21)11-12-33(25)15-18-5-3-6-20(13-18)29(34)35/h3-14,17H,15-16H2,1-2H3,(H,34,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	n/a	n/a	210	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Increase in human FXR-mediated transient transcription of luciferase reporter gene transfected in african green monkey CV1 cells				Bioorg Med Chem Lett 19: 4733-9 (2009) Article DOI: 10.1016/j.bmcl.2009.06.062 BindingDB Entry DOI: 10.7270/Q26H4HF6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bile acid receptor   (228/230 > 99%)† (Homo sapiens (Human))	BDBM50297952 (3-[(5-{[3-(2,6-dichlorophenyl)-5-(1-methylethyl)is...) Show SMILES CC(C)c1onc(c1COc1ccc2n(Cc3cccc(c3)C(O)=O)ccc2c1)-c1c(Cl)cccc1Cl |(15.25,-10.29,;15.64,-11.78,;14.53,-12.85,;17.12,-12.21,;18.35,-11.29,;19.6,-12.19,;19.14,-13.66,;17.6,-13.67,;16.84,-15,;15.3,-15.01,;14.53,-16.35,;12.99,-16.35,;12.23,-17.69,;13.01,-19.03,;12.56,-20.49,;11.21,-21.25,;9.89,-20.45,;8.55,-21.2,;7.22,-20.41,;7.25,-18.86,;8.6,-18.12,;9.92,-18.91,;8.62,-16.57,;7.3,-15.78,;9.97,-15.83,;13.81,-21.39,;15.04,-20.47,;14.55,-19.01,;15.31,-17.67,;19.94,-14.96,;21.47,-14.92,;22.2,-13.58,;22.27,-16.23,;21.54,-17.6,;20,-17.63,;19.19,-16.32,;17.65,-16.35,)| Show InChI InChI=1S/C29H24Cl2N2O4/c1-17(2)28-22(27(32-37-28)26-23(30)7-4-8-24(26)31)16-36-21-9-10-25-19(14-21)11-12-33(25)15-18-5-3-6-20(13-18)29(34)35/h3-14,17H,15-16H2,1-2H3,(H,34,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	n/a	n/a	320	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Induction of SRC1 coactivator peptide binding to ligand binding domain of human FXR by FRET assay				Bioorg Med Chem Lett 19: 4733-9 (2009) Article DOI: 10.1016/j.bmcl.2009.06.062 BindingDB Entry DOI: 10.7270/Q26H4HF6
					More data for this Ligand-Target Pair				3D Structure (crystal)

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