Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vasopressin V1b receptor' and Ligand = 'BDBM301705'   

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))	BDBM301705 (US10131692, Compound 37) Show SMILES CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(F)cc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N1CSC[C@H]1C(=O)N[C@H](CCCNC(N)=N)C(=O)NCc1cccs1 |r| Show InChI InChI=1S/C49H64ClFN12O9S3/c1-27(2)41-47(71)60-36(22-39(52)64)44(68)61-37(48(72)63-26-74-25-38(63)46(70)58-33(7-3-17-55-49(53)54)42(66)56-23-32-6-4-19-75-32)24-73-18-5-8-40(65)57-34(20-28-9-13-30(50)14-10-28)43(67)59-35(45(69)62-41)21-29-11-15-31(51)16-12-29/h4,6,9-16,19,27,33-38,41H,3,5,7-8,17-18,20-26H2,1-2H3,(H2,52,64)(H,56,66)(H,57,65)(H,58,70)(H,59,67)(H,60,71)(H,61,68)(H,62,69)(H4,53,54,55)/t33-,34+,35+,36+,37+,38+,41+/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.01E+5	n/a	n/a	n/a	n/a
Ferring B.V. US Patent					Assay Description To determine selectivity, compounds were tested in luciferase-based transcriptional reporter gene assays expressing the human V1b receptor (hV1bR). A...				US Patent US10131692 (2018) BindingDB Entry DOI: 10.7270/Q2WQ05TR
					More data for this Ligand-Target Pair