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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin E2 receptor EP2 subtype' and Ligand = 'BDBM50117681'   
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
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50117681
PNG
(3-(4'-Phenethylsulfanylmethyl-biphenyl-2-yl)-propi...)
Show SMILES OC(=O)CCc1ccccc1-c1ccc(CSCCc2ccccc2)cc1
Show InChI InChI=1S/C24H24O2S/c25-24(26)15-14-21-8-4-5-9-23(21)22-12-10-20(11-13-22)18-27-17-16-19-6-2-1-3-7-19/h1-13H,14-18H2,(H,25,26)
PDB

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PC cid
PC sid
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PubMed
140n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity at human Prostanoid EP2 receptor.


Bioorg Med Chem Lett 12: 2583-6 (2002)


BindingDB Entry DOI: 10.7270/Q2QN663S
More data for this
Ligand-Target Pair