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BDBM50410637 CHEMBL2113210

SMILES: CCCCOc1ccc(cc1)S(=O)(=O)N(CC(=O)NN=C1C(=O)Nc2ccccc12)c1ccc(Cl)cc1

InChI Key: InChIKey=SRGYYVFVMRNETP-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50410637   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Oxytocin receptor


(HEK293)
BDBM50410637
PNG
(CHEMBL2113210)
Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N(CC(=O)NN=C1C(=O)Nc2ccccc12)c1ccc(Cl)cc1 |w:19.19|
Show InChI InChI=1S/C26H25ClN4O5S/c1-2-3-16-36-20-12-14-21(15-13-20)37(34,35)31(19-10-8-18(27)9-11-19)17-24(32)29-30-25-22-6-4-5-7-23(22)28-26(25)33/h4-15H,2-3,16-17H2,1H3,(H,29,32)(H,28,30,33)
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PC cid
PC sid
UniChem
Article
PubMed
18n/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