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SMILES: OCCc1csc(NC(=O)c2ccc(CNc3ccccc3C(F)(F)F)s2)n1

InChI Key: InChIKey=WLFKWVOZFNSZLL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50467578   
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
Stearoyl-CoA desaturase


(Homo sapiens (Human))		BDBM50467578
PNG
(CHEMBL4293631)
Show SMILES OCCc1csc(NC(=O)c2ccc(CNc3ccccc3C(F)(F)F)s2)n1
Show InChI InChI=1S/C18H16F3N3O2S2/c19-18(20,21)13-3-1-2-4-14(13)22-9-12-5-6-15(28-12)16(26)24-17-23-11(7-8-25)10-27-17/h1-6,10,22,25H,7-9H2,(H,23,24,26)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.90n/an/an/an/an/an/a



Japan Tobacco Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human SCD1 expressed in baculovirus expression system assessed as reduction in [3H]H2O production using stearoyl [9,10-3H]C...

Eur J Med Chem 158: 832-852 (2018)


Article DOI: 10.1016/j.ejmech.2018.09.003
BindingDB Entry DOI: 10.7270/Q21V5HN5
More data for this
Ligand-Target Pair