Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Vasopressin V1b receptor' and Ligand = 'BDBM260342'   

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 V1b receptor (Homo sapiens (Human))	BDBM260342 (US9522914, D-31) Show SMILES CC(C)(C)NC(=O)Cc1nn(-c2ccc(CCN3C4CCC3COC4)cc2)c(=O)n1-c1ccc(F)c(Cl)c1 Show InChI InChI=1S/C28H33ClFN5O3/c1-28(2,3)31-26(36)15-25-32-35(27(37)34(25)20-10-11-24(30)23(29)14-20)19-6-4-18(5-7-19)12-13-33-21-8-9-22(33)17-38-16-21/h4-7,10-11,14,21-22H,8-9,12-13,15-17H2,1-3H3,(H,31,36)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.90	n/a	n/a	n/a	n/a	7.4	25
TAISHO PHARMACEUTICAL CO., LTD US Patent					Assay Description Human V1b receptor was transiently expressed in 293FT cells (Invitrogen). The cells were collected and then homogenated in a 15 mmol/L tris-hydrochlo...				US Patent US9522914 (2016) BindingDB Entry DOI: 10.7270/Q2KS6PR7
					More data for this Ligand-Target Pair
Vasopressin V1b receptor (Homo sapiens (Human))	BDBM260342 (US9522914, D-31) Show SMILES CC(C)(C)NC(=O)Cc1nn(-c2ccc(CCN3C4CCC3COC4)cc2)c(=O)n1-c1ccc(F)c(Cl)c1 Show InChI InChI=1S/C28H33ClFN5O3/c1-28(2,3)31-26(36)15-25-32-35(27(37)34(25)20-10-11-24(30)23(29)14-20)19-6-4-18(5-7-19)12-13-33-21-8-9-22(33)17-38-16-21/h4-7,10-11,14,21-22H,8-9,12-13,15-17H2,1-3H3,(H,31,36)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.90	n/a	n/a	n/a	n/a	7.4	4
TAISHO PHARMACEUTICAL CO., LTD US Patent					Assay Description Human V1b receptor was transiently expressed in 293FT cells (Invitrogen). The cells were collected and then homogenated in a 15 mmol/L tris-hydrochlo...				US Patent US9522914 (2016) BindingDB Entry DOI: 10.7270/Q2WM1CB9
					More data for this Ligand-Target Pair