BindingDB logo
myBDB logout

null

SMILES: OC(=O)Cn1nnc(n1)-c1ccnc(c1)-c1cn(Cc2cc(Cl)c(Cl)c(Cl)c2)nn1

InChI Key: InChIKey=ANDQBCBKLXPHQY-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 = 50356904   
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))		BDBM50356904
PNG
(CHEMBL1915553)
Show SMILES OC(=O)Cn1nnc(n1)-c1ccnc(c1)-c1cn(Cc2cc(Cl)c(Cl)c(Cl)c2)nn1
Show InChI InChI=1S/C17H11Cl3N8O2/c18-11-3-9(4-12(19)16(11)20)6-27-7-14(22-25-27)13-5-10(1-2-21-13)17-23-26-28(24-17)8-15(29)30/h1-5,7H,6,8H2,(H,29,30)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.31E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibition of rat SCD by rat microsomal assay

Bioorg Med Chem Lett 21: 6505-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.073
BindingDB Entry DOI: 10.7270/Q2VQ332W
More data for this
Ligand-Target Pair