Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 360.4 BDBM174874

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Acyl-CoA desaturase 1 (Rattus norvegicus (Rat))	BDBM174874 (US9102669, 48) Show SMILES Cn1cc(cn1)-c1ccc(nn1)N1CCC(CC1)n1nnc2ccccc12 Show InChI InChI=1S/C19H20N8/c1-25-13-14(12-20-25)16-6-7-19(23-21-16)26-10-8-15(9-11-26)27-18-5-3-2-4-17(18)22-24-27/h2-7,12-13,15H,8-11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	939	n/a	n/a	n/a	n/a	n/a	25
Janssen Pharmaceutica NV US Patent					Assay Description The SCD1 enzymatic assay was done in a volume of 50 μL using 10 μg of RLM (prepared as described above) in a 96-well polypropylene plate (e...				US Patent US9102669 (2015) BindingDB Entry DOI: 10.7270/Q2BC3X9V
					More data for this Ligand-Target Pair