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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vasopressin V1b receptor' and Ligand = 'BDBM50466882'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Vasopressin V1b receptor


(Homo sapiens (Human))		BDBM50466882
PNG
(CHEMBL4280894)
Show SMILES CCOc1nc(Cl)ccc1C1(N2CCN(CC2)c2ccncc2)C(=O)N(c2ccc(cc12)C#N)S(=O)(=O)c1ccc(OC)cn1
Show InChI InChI=1S/C31H28ClN7O5S/c1-3-44-29-24(6-8-27(32)36-29)31(38-16-14-37(15-17-38)22-10-12-34-13-11-22)25-18-21(19-33)4-7-26(25)39(30(31)40)45(41,42)28-9-5-23(43-2)20-35-28/h4-13,18,20H,3,14-17H2,1-2H3
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
 1.10n/an/an/an/an/an/an/an/a



AbbVie Deutschland GmbH & Co. KG

Curated by ChEMBL


Assay Description
Displacement of [3H]AVP from human vasopressin V1b receptor expressed in CHO cell membranes after 60 mins by TopCount microplate scintillation counti...

Bioorg Med Chem Lett 28: 3260-3264 (2018)


Article DOI: 10.1016/j.bmcl.2018.07.043
BindingDB Entry DOI: 10.7270/Q2CC13CC
More data for this
Ligand-Target Pair