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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 = 'BDBM50417692'   
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))		BDBM50417692
PNG
(CHEMBL1643588)
Show SMILES CCCNCc1ccc(cc1)-c1nc(CN(C2CCCC2)S(=O)(=O)c2ccc(OC)cc2)cs1
Show InChI InChI=1S/C26H33N3O3S2/c1-3-16-27-17-20-8-10-21(11-9-20)26-28-22(19-33-26)18-29(23-6-4-5-7-23)34(30,31)25-14-12-24(32-2)13-15-25/h8-15,19,23,27H,3-7,16-18H2,1-2H3
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Article
PubMed
 100n/an/an/an/an/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant V1b receptor expressed in CHO cells assessed as inhibition of vasopressin-induced calcium release after 10 mins by...

Bioorg Med Chem Lett 21: 92-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.061
BindingDB Entry DOI: 10.7270/Q2639R01
More data for this
Ligand-Target Pair