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BDBM50131616 4-Chloro-5-(3-chloro-4-methoxy-phenyl)-1-(4-methanesulfonyl-phenyl)-1H-imidazole::CHEMBL117295

SMILES: COc1ccc(cc1Cl)-c1c(Cl)ncn1-c1ccc(cc1)S(C)(=O)=O

InChI Key: InChIKey=VKBIYXIQBVJEPV-UHFFFAOYSA-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 = 50131616   
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
Cyclooxygenase


(Homo sapiens (Human))
BDBM50131616
PNG
(4-Chloro-5-(3-chloro-4-methoxy-phenyl)-1-(4-methan...)
Show SMILES COc1ccc(cc1Cl)-c1c(Cl)ncn1-c1ccc(cc1)S(C)(=O)=O
Show InChI InChI=1S/C17H14Cl2N2O3S/c1-24-15-8-3-11(9-14(15)18)16-17(19)20-10-21(16)12-4-6-13(7-5-12)25(2,22)23/h3-10H,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8n/an/an/an/an/an/a



Domp&egrove; pha.r.ma s.p.a.

Curated by ChEMBL


Assay Description
In vitro percent inhibition of Prostaglandin G/H synthase 2 (COX-2) in human whole blood was determined


J Med Chem 46: 3463-75 (2003)


Article DOI: 10.1021/jm030765s
BindingDB Entry DOI: 10.7270/Q2HQ3Z98
More data for this
Ligand-Target Pair
Cyclooxygenase-1 (COX-1)


(Homo sapiens (Human))
BDBM50131616
PNG
(4-Chloro-5-(3-chloro-4-methoxy-phenyl)-1-(4-methan...)
Show SMILES COc1ccc(cc1Cl)-c1c(Cl)ncn1-c1ccc(cc1)S(C)(=O)=O
Show InChI InChI=1S/C17H14Cl2N2O3S/c1-24-15-8-3-11(9-14(15)18)16-17(19)20-10-21(16)12-4-6-13(7-5-12)25(2,22)23/h3-10H,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Domp&egrove; pha.r.ma s.p.a.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human Prostaglandin G/H synthase 1 (COX-1) in U-937 cells


J Med Chem 46: 3463-75 (2003)


Article DOI: 10.1021/jm030765s
BindingDB Entry DOI: 10.7270/Q2HQ3Z98
More data for this
Ligand-Target Pair