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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sterol O-acyltransferase 1' and Ligand = 'BDBM50433215'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Sterol O-acyltransferase 1


(Homo sapiens (Human))		BDBM50433215
PNG
(CHEMBL2375694)
Show SMILES CC(C)C(=O)O[C@H]1CC[C@@]2(C)[C@@H](C[C@H](OC(C)=O)[C@@]3(C)Oc4cc(oc(=O)c4[C@H](O)[C@H]23)-c2cccnc2)[C@]1(C)COC(C)=O |r|
Show InChI InChI=1S/C33H41NO10/c1-17(2)29(38)43-24-10-11-31(5)23(32(24,6)16-40-18(3)35)14-25(41-19(4)36)33(7)28(31)27(37)26-22(44-33)13-21(42-30(26)39)20-9-8-12-34-15-20/h8-9,12-13,15,17,23-25,27-28,37H,10-11,14,16H2,1-7H3/t23-,24+,25+,27+,28-,31+,32+,33-/m1/s1
PDB

KEGG

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PC cid
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UniChem

Similars
Article
PubMed
n/an/a 1.36E+4n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of ACAT1 (unknown origin)

Bioorg Med Chem Lett 23: 2659-62 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.088
BindingDB Entry DOI: 10.7270/Q20866P3
More data for this
Ligand-Target Pair