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BDBM50303668 CHEMBL566631::Thiophene-2-sulfonic Acid[(E)-3-(5-Fluoro-3-methyl-1-naphthalen-2-ylmethyl-1H-indol-7-yl)acryloyl]amide

SMILES: Cc1cn(Cc2ccc3ccccc3c2)c2c(\C=C\C(=O)NS(=O)(=O)c3cccs3)cc(F)cc12

InChI Key: InChIKey=RLAXHQZRRNURQB-ZHACJKMWSA-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 = 50303668   
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))
BDBM50303668
PNG
(CHEMBL566631 | Thiophene-2-sulfonic Acid[(E)-3-(5-...)
Show SMILES Cc1cn(Cc2ccc3ccccc3c2)c2c(\C=C\C(=O)NS(=O)(=O)c3cccs3)cc(F)cc12
Show InChI InChI=1S/C27H21FN2O3S2/c1-18-16-30(17-19-8-9-20-5-2-3-6-21(20)13-19)27-22(14-23(28)15-24(18)27)10-11-25(31)29-35(32,33)26-7-4-12-34-26/h2-16H,17H2,1H3,(H,29,31)/b11-10+
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 14n/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))
BDBM50303668
PNG
(CHEMBL566631 | Thiophene-2-sulfonic Acid[(E)-3-(5-...)
Show SMILES Cc1cn(Cc2ccc3ccccc3c2)c2c(\C=C\C(=O)NS(=O)(=O)c3cccs3)cc(F)cc12
Show InChI InChI=1S/C27H21FN2O3S2/c1-18-16-30(17-19-8-9-20-5-2-3-6-21(20)13-19)27-22(14-23(28)15-24(18)27)10-11-25(31)29-35(32,33)26-7-4-12-34-26/h2-16H,17H2,1H3,(H,29,31)/b11-10+
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 619n/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