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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 = 'BDBM50417711'   
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))		BDBM50417711
PNG
(CHEMBL1643607)
Show SMILES CCCCNCc1ccc(cc1)-c1nc(CN(C2CCCC2)S(=O)(=O)c2ccc(OC(F)(F)F)cc2)cs1
Show InChI InChI=1S/C27H32F3N3O3S2/c1-2-3-16-31-17-20-8-10-21(11-9-20)26-32-22(19-37-26)18-33(23-6-4-5-7-23)38(34,35)25-14-12-24(13-15-25)36-27(28,29)30/h8-15,19,23,31H,2-7,16-18H2,1H3
UniProtKB/SwissProt

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PC sid
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Similars
Article
PubMed
 2.00E+3n/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