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BDBM50182512 CHEMBL383793::N2,N6-diphenethylpyridine-2,6-dicarboxamide

SMILES: O=C(NCCc1ccccc1)c1cccc(n1)C(=O)NCCc1ccccc1

InChI Key: InChIKey=XAVSESQGFAJPCJ-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50182512   
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))
BDBM50182512
PNG
(CHEMBL383793 | N2,N6-diphenethylpyridine-2,6-dicar...)
Show SMILES O=C(NCCc1ccccc1)c1cccc(n1)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C23H23N3O2/c27-22(24-16-14-18-8-3-1-4-9-18)20-12-7-13-21(26-20)23(28)25-17-15-19-10-5-2-6-11-19/h1-13H,14-17H2,(H,24,27)(H,25,28)
PDB

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/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))
BDBM50182512
PNG
(CHEMBL383793 | N2,N6-diphenethylpyridine-2,6-dicar...)
Show SMILES O=C(NCCc1ccccc1)c1cccc(n1)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C23H23N3O2/c27-22(24-16-14-18-8-3-1-4-9-18)20-12-7-13-21(26-20)23(28)25-17-15-19-10-5-2-6-11-19/h1-13H,14-17H2,(H,24,27)(H,25,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+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