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BDBM50262531 CHEMBL476103::N-(3-(methylcarbamoyl)phenyl)-4-(2-(trifluoromethyl)benzoyl)piperazine-1-carboxamide

SMILES: CNC(=O)c1cccc(NC(=O)N2CCN(CC2)C(=O)c2ccccc2C(F)(F)F)c1

InChI Key: InChIKey=QUEIEQOWQAFPPI-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50262531   
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
Acyl-CoA desaturase 1


(Mus musculus)
BDBM50262531
PNG
(CHEMBL476103 | N-(3-(methylcarbamoyl)phenyl)-4-(2-...)
Show SMILES CNC(=O)c1cccc(NC(=O)N2CCN(CC2)C(=O)c2ccccc2C(F)(F)F)c1
Show InChI InChI=1S/C21H21F3N4O3/c1-25-18(29)14-5-4-6-15(13-14)26-20(31)28-11-9-27(10-12-28)19(30)16-7-2-3-8-17(16)21(22,23)24/h2-8,13H,9-12H2,1H3,(H,25,29)(H,26,31)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 700n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of mouse SCD1


Bioorg Med Chem Lett 18: 4298-302 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.088
BindingDB Entry DOI: 10.7270/Q2ST7PNG
More data for this
Ligand-Target Pair