Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vasopressin V2 receptor' and Ligand = 'BDBM50152975'   

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
Vasopressin V2 receptor (Homo sapiens (Human))	BDBM50152975 ((2S,4R)-4-Methoxy-2-(2-pyridin-2-yl-ethylthiocarba...) Show SMILES CO[C@@H]1C[C@H](N(C1)C(=O)NCc1ccc(cc1Cl)C(=O)N1CCCCc2sccc12)C(=S)NCCc1ccccn1 Show InChI InChI=1S/C30H34ClN5O3S2/c1-39-23-17-26(28(40)33-13-10-22-6-2-4-12-32-22)36(19-23)30(38)34-18-21-9-8-20(16-24(21)31)29(37)35-14-5-3-7-27-25(35)11-15-41-27/h2,4,6,8-9,11-12,15-16,23,26H,3,5,7,10,13-14,17-19H2,1H3,(H,33,40)(H,34,38)/t23-,26+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a
Ferring Research Ltd Curated by ChEMBL					Assay Description Effective concentration for human Vassopressin V2 receptor				Bioorg Med Chem Lett 14: 4585-9 (2004) Article DOI: 10.1016/j.bmcl.2004.04.107 BindingDB Entry DOI: 10.7270/Q2DF6QPR
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