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BDBM50255780 3-(1-(3-chlorobenzyl)-3a-methyl-2-oxo-2,3,3a,4,5,6-hexahydro-1H-indol-7-yl)-N-(4,5-dichlorothiophen-2-ylsulfonyl)acrylamide::CHEMBL479275

SMILES: CC12CC(=O)N(Cc3cccc(Cl)c3)C1=C(CCC2)\C=C\C(=O)NS(=O)(=O)c1cc(Cl)c(Cl)s1

InChI Key: InChIKey=RIKJKWKHUFEWSI-BQYQJAHWSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50255780   
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
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50255780
PNG
(3-(1-(3-chlorobenzyl)-3a-methyl-2-oxo-2,3,3a,4,5,6...)
Show SMILES CC12CC(=O)N(Cc3cccc(Cl)c3)C1=C(CCC2)\C=C\C(=O)NS(=O)(=O)c1cc(Cl)c(Cl)s1 |c:16|
Show InChI InChI=1S/C23H21Cl3N2O4S2/c1-23-9-3-5-15(7-8-18(29)27-34(31,32)20-11-17(25)22(26)33-20)21(23)28(19(30)12-23)13-14-4-2-6-16(24)10-14/h2,4,6-8,10-11H,3,5,9,12-13H2,1H3,(H,27,29)/b8-7+
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.20n/an/an/an/an/an/a



deCODE Chemistry, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor


Bioorg Med Chem Lett 19: 778-82 (2009)


Article DOI: 10.1016/j.bmcl.2008.12.027
BindingDB Entry DOI: 10.7270/Q24M94DH
More data for this
Ligand-Target Pair