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BDBM50193722 4-(2,4-dimethylpent-3-en-2-yl)-1,6,7-trihydroxy-3-methyl-9H-xanthen-9-one::CHEMBL218383

SMILES: [#6]\[#6](-[#6])=[#6]/C([#6])([#6])c1c(-[#6])cc(-[#8])c2c1oc1cc(-[#8])c(-[#8])cc1c2=O

InChI Key: InChIKey=BFCORSRKGHOBIS-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50193722   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Sterol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50193722
PNG
(4-(2,4-dimethylpent-3-en-2-yl)-1,6,7-trihydroxy-3-...)
Show SMILES [#6]\[#6](-[#6])=[#6]/C([#6])([#6])c1c(-[#6])cc(-[#8])c2c1oc1cc(-[#8])c(-[#8])cc1c2=O
Show InChI InChI=1S/C21H22O5/c1-10(2)9-21(4,5)18-11(3)6-15(24)17-19(25)12-7-13(22)14(23)8-16(12)26-20(17)18/h6-9,22-24H,1-5H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.96E+4n/an/an/an/an/an/a



National Research Laboratory of Lipid Metabolism and Atherosclerosis

Curated by ChEMBL


Assay Description
Inhibition of human ACAT1 expressed in Hi5 cells


Bioorg Med Chem Lett 16: 5580-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.032
BindingDB Entry DOI: 10.7270/Q2PV6K0R
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Homo sapiens (Human))
BDBM50193722
PNG
(4-(2,4-dimethylpent-3-en-2-yl)-1,6,7-trihydroxy-3-...)
Show SMILES [#6]\[#6](-[#6])=[#6]/C([#6])([#6])c1c(-[#6])cc(-[#8])c2c1oc1cc(-[#8])c(-[#8])cc1c2=O
Show InChI InChI=1S/C21H22O5/c1-10(2)9-21(4,5)18-11(3)6-15(24)17-19(25)12-7-13(22)14(23)8-16(12)26-20(17)18/h6-9,22-24H,1-5H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.16E+4n/an/an/an/an/an/a



National Research Laboratory of Lipid Metabolism and Atherosclerosis

Curated by ChEMBL


Assay Description
Inhibition of human ACAT2 expressed in Hi5 cells


Bioorg Med Chem Lett 16: 5580-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.032
BindingDB Entry DOI: 10.7270/Q2PV6K0R
More data for this
Ligand-Target Pair