BindingDB logo
myBDB logout

null

SMILES: FC(F)(F)c1ccccc1C(=O)N1CCN(CC1)c1nc2ccc(NC(=O)Cc3cccs3)cc2[nH]1

InChI Key: InChIKey=MWCGRUFYUVJKFO-UHFFFAOYSA-N

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 1 hit for monomerid = 50429969   
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


(Rattus norvegicus (Rat))		BDBM50429969
PNG
(CHEMBL2334647)
Show SMILES FC(F)(F)c1ccccc1C(=O)N1CCN(CC1)c1nc2ccc(NC(=O)Cc3cccs3)cc2[nH]1
Show InChI InChI=1S/C25H22F3N5O2S/c26-25(27,28)19-6-2-1-5-18(19)23(35)32-9-11-33(12-10-32)24-30-20-8-7-16(14-21(20)31-24)29-22(34)15-17-4-3-13-36-17/h1-8,13-14H,9-12,15H2,(H,29,34)(H,30,31)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.20E+3n/an/an/an/an/an/a



Sanofi-Aventis Deutschland GmbH

Curated by ChEMBL


Assay Description
Inhibition of SCD1 in Wistar rat liver microsomes using [14C] stearic acid as substrate incubated for 10 mins prior to substrate addition measured af...

Bioorg Med Chem Lett 23: 1817-22 (2013)


Article DOI: 10.1016/j.bmcl.2013.01.030
BindingDB Entry DOI: 10.7270/Q2251KJJ
More data for this
Ligand-Target Pair