BDBM50450352 CHEMBL406757

SMILES: C(CSc1nc(c([nH]1)-c1ccccc1)-c1ccccc1)OCCSc1nc(c([nH]1)-c1ccccc1)-c1ccccc1

InChI Key: InChIKey=UXPSEUKVJZTNDO-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 = 50450352   

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
Sterol O-acyltransferase, Soat (Rattus norvegicus)	BDBM50450352 (CHEMBL406757) Show SMILES C(CSc1nc(c([nH]1)-c1ccccc1)-c1ccccc1)OCCSc1nc(c([nH]1)-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C34H30N4OS2/c1-5-13-25(14-6-1)29-30(26-15-7-2-8-16-26)36-33(35-29)40-23-21-39-22-24-41-34-37-31(27-17-9-3-10-18-27)32(38-34)28-19-11-4-12-20-28/h1-20H,21-24H2,(H,35,36)(H,37,38)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars		n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
The DuPont Merck Pharmaceutical Company Curated by ChEMBL					Assay Description In vitro inhibition of Acyl coenzyme A:cholesterol acyltransferase (ACAT) in rat hepatic microsomes				Bioorg Med Chem Lett 5: 173-6 (1995) BindingDB Entry DOI: 10.7270/Q2T72HDT
					More data for this Ligand-Target Pair
Acyl coenzyme A:cholesterol acyltransferase 1 (Mus musculus)	BDBM50450352 (CHEMBL406757) Show SMILES C(CSc1nc(c([nH]1)-c1ccccc1)-c1ccccc1)OCCSc1nc(c([nH]1)-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C34H30N4OS2/c1-5-13-25(14-6-1)29-30(26-15-7-2-8-16-26)36-33(35-29)40-23-21-39-22-24-41-34-37-31(27-17-9-3-10-18-27)32(38-34)28-19-11-4-12-20-28/h1-20H,21-24H2,(H,35,36)(H,37,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars		n/a	n/a	6.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
The DuPont Merck Pharmaceutical Company Curated by ChEMBL					Assay Description Inhibition of Acyl coenzyme A:cholesterol acyltransferase (ACAT) in J774 Macrophage cell culture				Bioorg Med Chem Lett 5: 173-6 (1995) BindingDB Entry DOI: 10.7270/Q2T72HDT
					More data for this Ligand-Target Pair