BDBM50461448 CHEMBL4227559

SMILES: C[C@@H](C[C@@H]1N(C)C(=O)[C@H](C[C@H](C)C(Cl)(Cl)Cl)N(C)C1=O)C(Cl)(Cl)Cl

InChI Key: InChIKey=FAXNAEOPEXUENY-XKNYDFJKSA-N

Data: 4 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 4 hits for monomerid = 50461448   

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 1 (Chlorocebus aethiops)	BDBM50461448 (CHEMBL4227559) Show SMILES C[C@@H](C[C@@H]1N(C)C(=O)[C@H](C[C@H](C)C(Cl)(Cl)Cl)N(C)C1=O)C(Cl)(Cl)Cl |r| Show InChI InChI=1S/C14H20Cl6N2O2/c1-7(13(15,16)17)5-9-11(23)22(4)10(12(24)21(9)3)6-8(2)14(18,19)20/h7-10H,5-6H2,1-4H3/t7-,8-,9-,10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku Medical and Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of African green monkey SOAT1 expressed in CHO cells assessed as decrease in [14C]CE synthesis from [14C]oleic acid after 6 hrs				Bioorg Med Chem Lett 28: 1911-1914 (2018) Article DOI: 10.1016/j.bmcl.2018.03.077 BindingDB Entry DOI: 10.7270/Q25Q4ZRC
					More data for this Ligand-Target Pair
Sterol O-acyltransferase 2 (Chlorocebus aethiops)	BDBM50461448 (CHEMBL4227559) Show SMILES C[C@@H](C[C@@H]1N(C)C(=O)[C@H](C[C@H](C)C(Cl)(Cl)Cl)N(C)C1=O)C(Cl)(Cl)Cl |r| Show InChI InChI=1S/C14H20Cl6N2O2/c1-7(13(15,16)17)5-9-11(23)22(4)10(12(24)21(9)3)6-8(2)14(18,19)20/h7-10H,5-6H2,1-4H3/t7-,8-,9-,10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku Medical and Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of African green monkey SOAT2 isolated from CHO cell microsomes assessed as decrease in [14C]CE synthesis from [14C]oleic acid after 5 min...				Bioorg Med Chem Lett 28: 1911-1914 (2018) Article DOI: 10.1016/j.bmcl.2018.03.077 BindingDB Entry DOI: 10.7270/Q25Q4ZRC
					More data for this Ligand-Target Pair
Sterol O-acyltransferase 1 (Chlorocebus aethiops)	BDBM50461448 (CHEMBL4227559) Show SMILES C[C@@H](C[C@@H]1N(C)C(=O)[C@H](C[C@H](C)C(Cl)(Cl)Cl)N(C)C1=O)C(Cl)(Cl)Cl |r| Show InChI InChI=1S/C14H20Cl6N2O2/c1-7(13(15,16)17)5-9-11(23)22(4)10(12(24)21(9)3)6-8(2)14(18,19)20/h7-10H,5-6H2,1-4H3/t7-,8-,9-,10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku Medical and Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of African green monkey SOAT1 isolated from CHO cell microsomes assessed as decrease in [14C]CE synthesis from [14C]oleic acid after 5 min...				Bioorg Med Chem Lett 28: 1911-1914 (2018) Article DOI: 10.1016/j.bmcl.2018.03.077 BindingDB Entry DOI: 10.7270/Q25Q4ZRC
					More data for this Ligand-Target Pair
Sterol O-acyltransferase 2 (Chlorocebus aethiops)	BDBM50461448 (CHEMBL4227559) Show SMILES C[C@@H](C[C@@H]1N(C)C(=O)[C@H](C[C@H](C)C(Cl)(Cl)Cl)N(C)C1=O)C(Cl)(Cl)Cl |r| Show InChI InChI=1S/C14H20Cl6N2O2/c1-7(13(15,16)17)5-9-11(23)22(4)10(12(24)21(9)3)6-8(2)14(18,19)20/h7-10H,5-6H2,1-4H3/t7-,8-,9-,10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku Medical and Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as decrease in [14C]CE synthesis from [14C]oleic acid after 6 hrs				Bioorg Med Chem Lett 28: 1911-1914 (2018) Article DOI: 10.1016/j.bmcl.2018.03.077 BindingDB Entry DOI: 10.7270/Q25Q4ZRC
					More data for this Ligand-Target Pair