Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Vasopressin V1b receptor' and Ligand = 'BDBM260345'   

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))	BDBM260345 (US9522914, D-34) Show SMILES CC(C)NC(=O)Cc1nn(-c2ccc(CC(C)N3C4CCC3COC4)cn2)c(=O)n1-c1cccc(Cl)c1 Show InChI InChI=1S/C27H33ClN6O3/c1-17(2)30-26(35)13-25-31-34(27(36)33(25)21-6-4-5-20(28)12-21)24-10-7-19(14-29-24)11-18(3)32-22-8-9-23(32)16-37-15-22/h4-7,10,12,14,17-18,22-23H,8-9,11,13,15-16H2,1-3H3,(H,30,35)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.30	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))	BDBM260345 (US9522914, D-34) Show SMILES CC(C)NC(=O)Cc1nn(-c2ccc(CC(C)N3C4CCC3COC4)cn2)c(=O)n1-c1cccc(Cl)c1 Show InChI InChI=1S/C27H33ClN6O3/c1-17(2)30-26(35)13-25-31-34(27(36)33(25)21-6-4-5-20(28)12-21)24-10-7-19(14-29-24)11-18(3)32-22-8-9-23(32)16-37-15-22/h4-7,10,12,14,17-18,22-23H,8-9,11,13,15-16H2,1-3H3,(H,30,35)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.30	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