Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 344.4 BDBM50329986

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

Found 3 hits 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))	BDBM50329986 (6-tert-butyl-2-(2'-fluorobiphenyl-4-yl)-1H-benzo[d...) Show SMILES CC(C)(C)c1ccc2nc([nH]c2c1)-c1ccc(cc1)-c1ccccc1F Show InChI InChI=1S/C23H21FN2/c1-23(2,3)17-12-13-20-21(14-17)26-22(25-20)16-10-8-15(9-11-16)18-6-4-5-7-19(18)24/h4-14H,1-3H3,(H,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	175	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of rat SCD1				Bioorg Med Chem Lett 20: 6366-9 (2010) Article DOI: 10.1016/j.bmcl.2010.09.094 BindingDB Entry DOI: 10.7270/Q20V8D1P
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase (Homo sapiens (Human))	BDBM50329986 (6-tert-butyl-2-(2'-fluorobiphenyl-4-yl)-1H-benzo[d...) Show SMILES CC(C)(C)c1ccc2nc([nH]c2c1)-c1ccc(cc1)-c1ccccc1F Show InChI InChI=1S/C23H21FN2/c1-23(2,3)17-12-13-20-21(14-17)26-22(25-20)16-10-8-15(9-11-16)18-6-4-5-7-19(18)24/h4-14H,1-3H3,(H,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	731	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of human SCD1				Bioorg Med Chem Lett 20: 6366-9 (2010) Article DOI: 10.1016/j.bmcl.2010.09.094 BindingDB Entry DOI: 10.7270/Q20V8D1P
					More data for this Ligand-Target Pair
Stearoyl-CoA desaturase 5 (Homo sapiens (Human))	BDBM50329986 (6-tert-butyl-2-(2'-fluorobiphenyl-4-yl)-1H-benzo[d...) Show SMILES CC(C)(C)c1ccc2nc([nH]c2c1)-c1ccc(cc1)-c1ccccc1F Show InChI InChI=1S/C23H21FN2/c1-23(2,3)17-12-13-20-21(14-17)26-22(25-20)16-10-8-15(9-11-16)18-6-4-5-7-19(18)24/h4-14H,1-3H3,(H,25,26)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of human SCD5				Bioorg Med Chem Lett 20: 6366-9 (2010) Article DOI: 10.1016/j.bmcl.2010.09.094 BindingDB Entry DOI: 10.7270/Q20V8D1P
					More data for this Ligand-Target Pair