Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vasopressin V1b receptor' and Ligand = 'BDBM50345080'   

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))	BDBM50345080 ((1,4-diazepan-1-yl)(1-(4-methoxy-2,3-dimethylpheny...) Show SMILES COc1ccc(c(C)c1C)S(=O)(=O)n1c(C)c(C(=O)N2CCCNCC2)c2cc(C)ccc12 Show InChI InChI=1S/C25H31N3O4S/c1-16-7-8-21-20(15-16)24(25(29)27-13-6-11-26-12-14-27)19(4)28(21)33(30,31)23-10-9-22(32-5)17(2)18(23)3/h7-10,15,26H,6,11-14H2,1-5H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	790	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
MSD Curated by ChEMBL					Assay Description Displacement of [3H]-AVP from human vasopressin V1B receptor expressed in CHO cells				Bioorg Med Chem Lett 21: 3603-7 (2011) Article DOI: 10.1016/j.bmcl.2011.04.104 BindingDB Entry DOI: 10.7270/Q2833SCQ
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