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BDBM50425303 CHEMBL2315513

SMILES: CC(=O)NCC(=O)N1CCC2(CC1)CCN(Cc1ccccc1)c1ccccc1O2

InChI Key: InChIKey=PRLRUWLTLSQZPC-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50425303   
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 1 (SCD1)


(Rattus norvegicus (Rat))
BDBM50425303
PNG
(CHEMBL2315513)
Show SMILES CC(=O)NCC(=O)N1CCC2(CC1)CCN(Cc1ccccc1)c1ccccc1O2
Show InChI InChI=1S/C24H29N3O3/c1-19(28)25-17-23(29)26-14-11-24(12-15-26)13-16-27(18-20-7-3-2-4-8-20)21-9-5-6-10-22(21)30-24/h2-10H,11-18H2,1H3,(H,25,28)
PDB

UniProtKB/SwissProt

GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of rat SCD1 by rat microsomal assay


Bioorg Med Chem Lett 23: 791-6 (2013)


Article DOI: 10.1016/j.bmcl.2012.11.075
BindingDB Entry DOI: 10.7270/Q26H4JQ6
More data for this
Ligand-Target Pair