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BDBM50182510 CHEMBL202582::N-(3-(2-methylbenzamido)phenyl)thiophene-2-carboxamide

SMILES: Cc1ccccc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1

InChI Key: InChIKey=LKPHCDSDJRIFEE-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50182510   
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
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50182510
PNG
(CHEMBL202582 | N-(3-(2-methylbenzamido)phenyl)thio...)
Show SMILES Cc1ccccc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1
Show InChI InChI=1S/C19H16N2O2S/c1-13-6-2-3-9-16(13)18(22)20-14-7-4-8-15(12-14)21-19(23)17-10-5-11-24-17/h2-12H,1H3,(H,20,22)(H,21,23)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of 15-hLO


J Med Chem 49: 1356-63 (2006)


Article DOI: 10.1021/jm050639j
BindingDB Entry DOI: 10.7270/Q2057FH3
More data for this
Ligand-Target Pair
12-Lipoxygenase (12-LOX)


(Homo sapiens (Human))
BDBM50182510
PNG
(CHEMBL202582 | N-(3-(2-methylbenzamido)phenyl)thio...)
Show SMILES Cc1ccccc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1
Show InChI InChI=1S/C19H16N2O2S/c1-13-6-2-3-9-16(13)18(22)20-14-7-4-8-15(12-14)21-19(23)17-10-5-11-24-17/h2-12H,1H3,(H,20,22)(H,21,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of 12-hLO


J Med Chem 49: 1356-63 (2006)


Article DOI: 10.1021/jm050639j
BindingDB Entry DOI: 10.7270/Q2057FH3
More data for this
Ligand-Target Pair