Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Vasopressin V1a/V1b/V2 receptor' and Ligand = 'BDBM50001378'   

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 V1a/V1b/V2 receptor (RAT-Rattus norvegicus (Rat))	BDBM50001378 (1'-(4-nitrobenzylsulfonyl)spiro[1H-indene-1,4'-(he...) Show SMILES [O-][N+](=O)c1ccc(CS(=O)(=O)N2CCC3(CC2)C=Cc2ccccc32)cc1 |c:18| Show InChI InChI=1S/C20H20N2O4S/c23-22(24)18-7-5-16(6-8-18)15-27(25,26)21-13-11-20(12-14-21)10-9-17-3-1-2-4-19(17)20/h1-10H,11-15H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Half-maximal inhibition of binding of [3H]vasopressin to vasopressin receptor 1 in rat liver				J Med Chem 35: 3919-27 (1992) BindingDB Entry DOI: 10.7270/Q2N015G7
					More data for this Ligand-Target Pair
Vasopressin V1a/V1b/V2 receptor (RAT-Rattus norvegicus (Rat))	BDBM50001378 (1'-(4-nitrobenzylsulfonyl)spiro[1H-indene-1,4'-(he...) Show SMILES [O-][N+](=O)c1ccc(CS(=O)(=O)N2CCC3(CC2)C=Cc2ccccc32)cc1 |c:18| Show InChI InChI=1S/C20H20N2O4S/c23-22(24)18-7-5-16(6-8-18)15-27(25,26)21-13-11-20(12-14-21)10-9-17-3-1-2-4-19(17)20/h1-10H,11-15H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Half-maximal inhibition of binding of [3H]- vasopressin to the vasopressin receptor 2 in rat kidney				J Med Chem 35: 3919-27 (1992) BindingDB Entry DOI: 10.7270/Q2N015G7
					More data for this Ligand-Target Pair