BDBM50445797 CHEMBL3104816

SMILES: Cc1nc(sc1C(=O)NCc1ccncc1)N1CCN(Cc2ccccc2)C1=O

InChI Key: InChIKey=VNZOYLVCXSIPLE-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50445797   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Stearoyl-CoA desaturase 1 (Homo sapiens (Human))	BDBM50445797 (CHEMBL3104816) Show SMILES Cc1nc(sc1C(=O)NCc1ccncc1)N1CCN(Cc2ccccc2)C1=O Show InChI InChI=1S/C21H21N5O2S/c1-15-18(19(27)23-13-16-7-9-22-10-8-16)29-20(24-15)26-12-11-25(21(26)28)14-17-5-3-2-4-6-17/h2-10H,11-14H2,1H3,(H,23,27)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	656	n/a	n/a	n/a	n/a	n/a	n/a
Xenon Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of SCD1 in human HepG2 cells using [1-14C]stearic acid as substrate				Bioorg Med Chem Lett 24: 520-5 (2014) Article DOI: 10.1016/j.bmcl.2013.12.036 BindingDB Entry DOI: 10.7270/Q2QJ7JRS
					More data for this Ligand-Target Pair
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50445797 (CHEMBL3104816) Show SMILES Cc1nc(sc1C(=O)NCc1ccncc1)N1CCN(Cc2ccccc2)C1=O Show InChI InChI=1S/C21H21N5O2S/c1-15-18(19(27)23-13-16-7-9-22-10-8-16)29-20(24-15)26-12-11-25(21(26)28)14-17-5-3-2-4-6-17/h2-10H,11-14H2,1H3,(H,23,27)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	145	n/a	n/a	n/a	n/a	n/a	n/a
Xenon Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of SCD1 in mouse liver microsomes				Bioorg Med Chem Lett 24: 520-5 (2014) Article DOI: 10.1016/j.bmcl.2013.12.036 BindingDB Entry DOI: 10.7270/Q2QJ7JRS
					More data for this Ligand-Target Pair