BindingDB logo
myBDB logout

BDBM50371014 CHEMBL230290

SMILES: Clc1ccccc1OC1CCN(CC1)C(=O)CNc1nccnc1C(=O)Nc1ccccc1

InChI Key: InChIKey=HLMDZKBPECJZAW-UHFFFAOYSA-N

Data: 1 IC50

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 = 50371014   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Stearoyl-CoA desaturase 1


(Homo sapiens (Human))
BDBM50371014
PNG
(CHEMBL230290)
Show SMILES Clc1ccccc1OC1CCN(CC1)C(=O)CNc1nccnc1C(=O)Nc1ccccc1
Show InChI InChI=1S/C24H24ClN5O3/c25-19-8-4-5-9-20(19)33-18-10-14-30(15-11-18)21(31)16-28-23-22(26-12-13-27-23)24(32)29-17-6-2-1-3-7-17/h1-9,12-13,18H,10-11,14-16H2,(H,27,28)(H,29,32)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 550n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human SCD1


Bioorg Med Chem Lett 17: 3388-91 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.099
BindingDB Entry DOI: 10.7270/Q20K29DB
More data for this
Ligand-Target Pair