BDBM50429585 CHEMBL2334204

SMILES: CC(=O)OC[C@]1(C)[C@H](CC[C@@]2(C)[C@H]1C[C@H](OC(=O)c1cccc(C=C)c1)[C@@]1(C)Oc3cc(oc(=O)c3[C@H](O)[C@H]21)-c1cccnc1)OC(C)=O

InChI Key: InChIKey=FJCQBLMYDVANLB-DYBHYMMPSA-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 = 50429585   

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 (Homo sapiens (Human))	BDBM50429585 (CHEMBL2334204) Show SMILES CC(=O)OC[C@]1(C)[C@H](CC[C@@]2(C)[C@H]1C[C@H](OC(=O)c1cccc(C=C)c1)[C@@]1(C)Oc3cc(oc(=O)c3[C@H](O)[C@H]21)-c1cccnc1)OC(C)=O |r| Show InChI InChI=1S/C38H41NO10/c1-7-23-10-8-11-24(16-23)34(43)48-30-18-28-36(4,14-13-29(46-22(3)41)37(28,5)20-45-21(2)40)33-32(42)31-27(49-38(30,33)6)17-26(47-35(31)44)25-12-9-15-39-19-25/h7-12,15-17,19,28-30,32-33,42H,1,13-14,18,20H2,2-6H3/t28-,29+,30+,32+,33-,36+,37+,38-/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Inhibition of ACAT1 (unknown origin) expressed in CHO cells				Bioorg Med Chem Lett 23: 1285-7 (2013) Article DOI: 10.1016/j.bmcl.2012.12.099 BindingDB Entry DOI: 10.7270/Q2P270HW
					More data for this Ligand-Target Pair
Sterol O-acyltransferase 2 (Homo sapiens (Human))	BDBM50429585 (CHEMBL2334204) Show SMILES CC(=O)OC[C@]1(C)[C@H](CC[C@@]2(C)[C@H]1C[C@H](OC(=O)c1cccc(C=C)c1)[C@@]1(C)Oc3cc(oc(=O)c3[C@H](O)[C@H]21)-c1cccnc1)OC(C)=O |r| Show InChI InChI=1S/C38H41NO10/c1-7-23-10-8-11-24(16-23)34(43)48-30-18-28-36(4,14-13-29(46-22(3)41)37(28,5)20-45-21(2)40)33-32(42)31-27(49-38(30,33)6)17-26(47-35(31)44)25-12-9-15-39-19-25/h7-12,15-17,19,28-30,32-33,42H,1,13-14,18,20H2,2-6H3/t28-,29+,30+,32+,33-,36+,37+,38-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Inhibition of ACAT2 (unknown origin) expressed in CHO cells				Bioorg Med Chem Lett 23: 1285-7 (2013) Article DOI: 10.1016/j.bmcl.2012.12.099 BindingDB Entry DOI: 10.7270/Q2P270HW
					More data for this Ligand-Target Pair