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BDBM50303696 CHEMBL565597::Thiophene-2-sulfonic Acid{(E)-3-[1-(3,4-Dichlorobenzyl)-3-methyl-1H-indol-7-yl]acryloyl}amide

SMILES: Cc1cn(Cc2ccc(Cl)c(Cl)c2)c2c(\C=C\C(=O)NS(=O)(=O)c3cccs3)cccc12

InChI Key: InChIKey=WVSHSWWJXOFNLI-CSKARUKUSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50303696   
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))
BDBM50303696
PNG
(CHEMBL565597 | Thiophene-2-sulfonic Acid{(E)-3-[1-...)
Show SMILES Cc1cn(Cc2ccc(Cl)c(Cl)c2)c2c(\C=C\C(=O)NS(=O)(=O)c3cccs3)cccc12
Show InChI InChI=1S/C23H18Cl2N2O3S2/c1-15-13-27(14-16-7-9-19(24)20(25)12-16)23-17(4-2-5-18(15)23)8-10-21(28)26-32(29,30)22-6-3-11-31-22/h2-13H,14H2,1H3,(H,26,28)/b10-8+
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 14.2n/an/an/an/an/an/a



deCODE Chemistry, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor after 1 hr by liquid scintillation counting


J Med Chem 53: 18-36 (2010)


Article DOI: 10.1021/jm9005912
BindingDB Entry DOI: 10.7270/Q2XP752H
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50303696
PNG
(CHEMBL565597 | Thiophene-2-sulfonic Acid{(E)-3-[1-...)
Show SMILES Cc1cn(Cc2ccc(Cl)c(Cl)c2)c2c(\C=C\C(=O)NS(=O)(=O)c3cccs3)cccc12
Show InChI InChI=1S/C23H18Cl2N2O3S2/c1-15-13-27(14-16-7-9-19(24)20(25)12-16)23-17(4-2-5-18(15)23)8-10-21(28)26-32(29,30)22-6-3-11-31-22/h2-13H,14H2,1H3,(H,26,28)/b10-8+
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.16E+3n/an/an/an/an/an/a



deCODE Chemistry, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGE2 from human EP3 receptor after 1 hr by liquid scintillation counting in presence of 10% human serum


J Med Chem 53: 18-36 (2010)


Article DOI: 10.1021/jm9005912
BindingDB Entry DOI: 10.7270/Q2XP752H
More data for this
Ligand-Target Pair