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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Oxytocin receptor' and Ligand = 'BDBM50178191'   
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
Oxytocin receptor


(Homo sapiens (Human))
BDBM50178191
PNG
(CHEMBL382515 | N-(4-methylphenyl)-N-{2-oxo-2-[2-(2...)
Show SMILES Cc1ccc(cc1)N(CC(=O)N=Nc1c(O)[nH]c2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccccc1 |w:11.11|
Show InChI InChI=1S/C29H24N4O4S/c1-20-11-15-23(16-12-20)33(19-27(34)31-32-28-25-9-5-6-10-26(25)30-29(28)35)38(36,37)24-17-13-22(14-18-24)21-7-3-2-4-8-21/h2-18,30,35H,19H2,1H3
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Article
PubMed
104n/an/an/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]OVTA antagonist from human oxytocin receptor expressed in HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair