Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Oxytocin receptor' and Ligand = 'BDBM50002422'   

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
Oxytocin receptor (Homo sapiens (Human))	BDBM50002422 (CHEMBL372516) Show SMILES CC(C)C[C@H]1N([C@H](C(=O)NC(C)(C)C)c2ccc(OC(F)(F)F)cc2)C(=O)[C@H](NC1=O)C1Cc2ccccc2C1 Show InChI InChI=1S/C30H36F3N3O4/c1-17(2)14-23-26(37)34-24(21-15-19-8-6-7-9-20(19)16-21)28(39)36(23)25(27(38)35-29(3,4)5)18-10-12-22(13-11-18)40-30(31,32)33/h6-13,17,21,23-25H,14-16H2,1-5H3,(H,34,37)(H,35,38)/t23-,24-,25+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	158	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research and Development Curated by ChEMBL					Assay Description Displacement of [3H]oxytocin from human Oxytocin receptor				J Med Chem 48: 6956-69 (2005) Checked by Author Article DOI: 10.1021/jm050557v BindingDB Entry DOI: 10.7270/Q2TX3GWZ
					More data for this Ligand-Target Pair