Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Vasopressin V1a receptor' and Ligand = 'BDBM192445'   

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 receptor (Homo sapiens (Human))	BDBM192445 (US9187466, 9 | US9687476, 9) Show SMILES O[C@@H](Cn1c(nn(Cc2nc(no2)-c2ccccc2C(F)(F)F)c1=O)-c1ccc(Cl)cc1)C(F)(F)F |r| Show InChI InChI=1S/C21H14ClF6N5O3/c22-12-7-5-11(6-8-12)18-30-33(19(35)32(18)9-15(34)21(26,27)28)10-16-29-17(31-36-16)13-3-1-2-4-14(13)20(23,24)25/h1-8,15,34H,9-10H2/t15-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	37
Bayer Intellectual Property GmbH US Patent					Assay Description On the day before the assay, the cells are plated out in culture medium (DMEM, 10% FCS, 2 mM glutamine, 10 mM HEPES) in 384-well microtiter plates an...				US Patent US9687476 (2017) BindingDB Entry DOI: 10.7270/Q2ZG6QDG
					More data for this Ligand-Target Pair
Vasopressin V1a receptor (Homo sapiens (Human))	BDBM192445 (US9187466, 9 | US9687476, 9) Show SMILES O[C@@H](Cn1c(nn(Cc2nc(no2)-c2ccccc2C(F)(F)F)c1=O)-c1ccc(Cl)cc1)C(F)(F)F |r| Show InChI InChI=1S/C21H14ClF6N5O3/c22-12-7-5-11(6-8-12)18-30-33(19(35)32(18)9-15(34)21(26,27)28)10-16-29-17(31-36-16)13-3-1-2-4-14(13)20(23,24)25/h1-8,15,34H,9-10H2/t15-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Bayer Intellectual Property GmbH US Patent					Assay Description On the day before the assay, the cells are plated out in culture medium (DMEM, 10% FCS, 2 mM glutamine, 10 mM HEPES) in 384-well microtiter plates an...				US Patent US9187466 (2015) BindingDB Entry DOI: 10.7270/Q2WQ02MT
					More data for this Ligand-Target Pair