Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 477.5 BDBM174883

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))	BDBM174883 (US9102669, 71) Show SMILES Fc1ccc2CCN(C3CCN(CC3)c3ccc(nn3)-c3cnn(CCN4CCOCC4)c3)c2c1 Show InChI InChI=1S/C26H32FN7O/c27-22-2-1-20-5-10-34(25(20)17-22)23-6-8-32(9-7-23)26-4-3-24(29-30-26)21-18-28-33(19-21)12-11-31-13-15-35-16-14-31/h1-4,17-19,23H,5-16H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	275	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
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