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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50410633   
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))		BDBM50410633
PNG
(CHEMBL2113195)
Show SMILES COC(=O)c1cccc2\C(=N\NC(=O)CN(c3ccc(Cl)cc3)S(=O)(=O)c3ccc(OCCCN(C)C)cc3)C(=O)Nc12
Show InChI InChI=1S/C29H30ClN5O7S/c1-34(2)16-5-17-42-21-12-14-22(15-13-21)43(39,40)35(20-10-8-19(30)9-11-20)18-25(36)32-33-27-23-6-4-7-24(29(38)41-3)26(23)31-28(27)37/h4,6-15H,5,16-18H2,1-3H3,(H,32,36)(H,31,33,37)
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Article
PubMed
 109n/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