Found 27 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Acyl-CoA:cholesterol acyltransferase
(Oryctolagus cuniculus) | BDBM50079715
(CHEMBL64237 | Tetradecanethioic acid (2,6-diisopro...)Show InChI InChI=1S/C26H45NS/c1-6-7-8-9-10-11-12-13-14-15-16-20-25(28)27-26-23(21(2)3)18-17-19-24(26)22(4)5/h17-19,21-22H,6-16,20H2,1-5H3,(H,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/TrEMBL
DrugBank
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit adrenal gland |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Acyl-CoA:cholesterol acyltransferase
(Oryctolagus cuniculus) | BDBM50079715
(CHEMBL64237 | Tetradecanethioic acid (2,6-diisopro...)Show InChI InChI=1S/C26H45NS/c1-6-7-8-9-10-11-12-13-14-15-16-20-25(28)27-26-23(21(2)3)18-17-19-24(26)22(4)5/h17-19,21-22H,6-16,20H2,1-5H3,(H,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/TrEMBL
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit liver |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079716
((5E,8E,11E,14E,17E,20E)-Docosa-5,8,11,14,17,20-hex...)Show SMILES C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)Nc1c(cccc1C(C)C)C(C)C Show InChI InChI=1S/C34H49NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-33(36)35-34-31(29(2)3)26-25-27-32(34)30(4)5/h6-7,9-10,12-13,15-16,18-19,21-22,25-27,29-30H,8,11,14,17,20,23-24,28H2,1-5H3,(H,35,36)/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+ | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from canine liver |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079716
((5E,8E,11E,14E,17E,20E)-Docosa-5,8,11,14,17,20-hex...)Show SMILES C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)Nc1c(cccc1C(C)C)C(C)C Show InChI InChI=1S/C34H49NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-33(36)35-34-31(29(2)3)26-25-27-32(34)30(4)5/h6-7,9-10,12-13,15-16,18-19,21-22,25-27,29-30H,8,11,14,17,20,23-24,28H2,1-5H3,(H,35,36)/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+ | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from canine adrenal gland |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079716
((5E,8E,11E,14E,17E,20E)-Docosa-5,8,11,14,17,20-hex...)Show SMILES C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)Nc1c(cccc1C(C)C)C(C)C Show InChI InChI=1S/C34H49NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-33(36)35-34-31(29(2)3)26-25-27-32(34)30(4)5/h6-7,9-10,12-13,15-16,18-19,21-22,25-27,29-30H,8,11,14,17,20,23-24,28H2,1-5H3,(H,35,36)/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+ | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit liver |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079716
((5E,8E,11E,14E,17E,20E)-Docosa-5,8,11,14,17,20-hex...)Show SMILES C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)Nc1c(cccc1C(C)C)C(C)C Show InChI InChI=1S/C34H49NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-33(36)35-34-31(29(2)3)26-25-27-32(34)30(4)5/h6-7,9-10,12-13,15-16,18-19,21-22,25-27,29-30H,8,11,14,17,20,23-24,28H2,1-5H3,(H,35,36)/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+ | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit liver |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Acyl-CoA:cholesterol acyltransferase
(Oryctolagus cuniculus) | BDBM50079716
((5E,8E,11E,14E,17E,20E)-Docosa-5,8,11,14,17,20-hex...)Show SMILES C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)Nc1c(cccc1C(C)C)C(C)C Show InChI InChI=1S/C34H49NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-33(36)35-34-31(29(2)3)26-25-27-32(34)30(4)5/h6-7,9-10,12-13,15-16,18-19,21-22,25-27,29-30H,8,11,14,17,20,23-24,28H2,1-5H3,(H,35,36)/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+ | PDB
Reactome pathway
KEGG
UniProtKB/TrEMBL
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit intestine |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Acyl-CoA:cholesterol acyltransferase
(Oryctolagus cuniculus) | BDBM50079716
((5E,8E,11E,14E,17E,20E)-Docosa-5,8,11,14,17,20-hex...)Show SMILES C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)Nc1c(cccc1C(C)C)C(C)C Show InChI InChI=1S/C34H49NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-33(36)35-34-31(29(2)3)26-25-27-32(34)30(4)5/h6-7,9-10,12-13,15-16,18-19,21-22,25-27,29-30H,8,11,14,17,20,23-24,28H2,1-5H3,(H,35,36)/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+ | PDB
Reactome pathway
KEGG
UniProtKB/TrEMBL
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from canine intestine |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079715
(CHEMBL64237 | Tetradecanethioic acid (2,6-diisopro...)Show InChI InChI=1S/C26H45NS/c1-6-7-8-9-10-11-12-13-14-15-16-20-25(28)27-26-23(21(2)3)18-17-19-24(26)22(4)5/h17-19,21-22H,6-16,20H2,1-5H3,(H,27,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 89 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from canine adrenal gland |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079715
(CHEMBL64237 | Tetradecanethioic acid (2,6-diisopro...)Show InChI InChI=1S/C26H45NS/c1-6-7-8-9-10-11-12-13-14-15-16-20-25(28)27-26-23(21(2)3)18-17-19-24(26)22(4)5/h17-19,21-22H,6-16,20H2,1-5H3,(H,27,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 113 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from Caco-2 microsome in human |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079715
(CHEMBL64237 | Tetradecanethioic acid (2,6-diisopro...)Show InChI InChI=1S/C26H45NS/c1-6-7-8-9-10-11-12-13-14-15-16-20-25(28)27-26-23(21(2)3)18-17-19-24(26)22(4)5/h17-19,21-22H,6-16,20H2,1-5H3,(H,27,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from canine liver |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079715
(CHEMBL64237 | Tetradecanethioic acid (2,6-diisopro...)Show InChI InChI=1S/C26H45NS/c1-6-7-8-9-10-11-12-13-14-15-16-20-25(28)27-26-23(21(2)3)18-17-19-24(26)22(4)5/h17-19,21-22H,6-16,20H2,1-5H3,(H,27,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 137 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from canine intestine |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079715
(CHEMBL64237 | Tetradecanethioic acid (2,6-diisopro...)Show InChI InChI=1S/C26H45NS/c1-6-7-8-9-10-11-12-13-14-15-16-20-25(28)27-26-23(21(2)3)18-17-19-24(26)22(4)5/h17-19,21-22H,6-16,20H2,1-5H3,(H,27,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 141 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit intestine |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Acyl-CoA:cholesterol acyltransferase
(Oryctolagus cuniculus) | BDBM50005944
(2,2-Dimethyl-dodecanoic acid (2,4,6-trimethoxy-phe...)Show InChI InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/TrEMBL
DrugBank
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
PubMed
| n/a | n/a | 152 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from Caco-2 microsome in human |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Acyl-CoA:cholesterol acyltransferase
(Oryctolagus cuniculus) | BDBM50005944
(2,2-Dimethyl-dodecanoic acid (2,4,6-trimethoxy-phe...)Show InChI InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/TrEMBL
DrugBank
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
PubMed
| n/a | n/a | 191 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit liver |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Acyl-CoA:cholesterol acyltransferase
(Oryctolagus cuniculus) | BDBM50079716
((5E,8E,11E,14E,17E,20E)-Docosa-5,8,11,14,17,20-hex...)Show SMILES C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)Nc1c(cccc1C(C)C)C(C)C Show InChI InChI=1S/C34H49NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-33(36)35-34-31(29(2)3)26-25-27-32(34)30(4)5/h6-7,9-10,12-13,15-16,18-19,21-22,25-27,29-30H,8,11,14,17,20,23-24,28H2,1-5H3,(H,35,36)/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+ | PDB
Reactome pathway
KEGG
UniProtKB/TrEMBL
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 228 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from Caco-2 microsome in human |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079715
(CHEMBL64237 | Tetradecanethioic acid (2,6-diisopro...)Show InChI InChI=1S/C26H45NS/c1-6-7-8-9-10-11-12-13-14-15-16-20-25(28)27-26-23(21(2)3)18-17-19-24(26)22(4)5/h17-19,21-22H,6-16,20H2,1-5H3,(H,27,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 281 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit adrenal gland |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Acyl-CoA:cholesterol acyltransferase
(Oryctolagus cuniculus) | BDBM50079715
(CHEMBL64237 | Tetradecanethioic acid (2,6-diisopro...)Show InChI InChI=1S/C26H45NS/c1-6-7-8-9-10-11-12-13-14-15-16-20-25(28)27-26-23(21(2)3)18-17-19-24(26)22(4)5/h17-19,21-22H,6-16,20H2,1-5H3,(H,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/TrEMBL
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 554 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit intestine |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50005944
(2,2-Dimethyl-dodecanoic acid (2,4,6-trimethoxy-phe...)Show InChI InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
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| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
PubMed
| n/a | n/a | 619 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from canine intestine |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50005944
(2,2-Dimethyl-dodecanoic acid (2,4,6-trimethoxy-phe...)Show InChI InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
PubMed
| n/a | n/a | 838 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from HepG2 microsome in human |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50005944
(2,2-Dimethyl-dodecanoic acid (2,4,6-trimethoxy-phe...)Show InChI InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25) | PDB
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| PDB
PubMed
| n/a | n/a | 926 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from U937 microsome in human |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Acyl-CoA:cholesterol acyltransferase
(Oryctolagus cuniculus) | BDBM50005944
(2,2-Dimethyl-dodecanoic acid (2,4,6-trimethoxy-phe...)Show InChI InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25) | PDB
Reactome pathway
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| PDB
PubMed
| n/a | n/a | 1.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from rabbit adrenal gland |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079716
((5E,8E,11E,14E,17E,20E)-Docosa-5,8,11,14,17,20-hex...)Show SMILES C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)Nc1c(cccc1C(C)C)C(C)C Show InChI InChI=1S/C34H49NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-33(36)35-34-31(29(2)3)26-25-27-32(34)30(4)5/h6-7,9-10,12-13,15-16,18-19,21-22,25-27,29-30H,8,11,14,17,20,23-24,28H2,1-5H3,(H,35,36)/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+ | PDB
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| n/a | n/a | 3.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from canine liver |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50005944
(2,2-Dimethyl-dodecanoic acid (2,4,6-trimethoxy-phe...)Show InChI InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25) | PDB
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| PDB
PubMed
| n/a | n/a | 4.59E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from HepG2 microsome in human |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50005944
(2,2-Dimethyl-dodecanoic acid (2,4,6-trimethoxy-phe...)Show InChI InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25) | PDB
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| PDB
PubMed
| n/a | n/a | 4.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from canine adrenal gland |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50005944
(2,2-Dimethyl-dodecanoic acid (2,4,6-trimethoxy-phe...)Show InChI InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25) | PDB
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| PDB
PubMed
| n/a | n/a | 5.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from U937 microsome in human |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Sterol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50079716
((5E,8E,11E,14E,17E,20E)-Docosa-5,8,11,14,17,20-hex...)Show SMILES C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)Nc1c(cccc1C(C)C)C(C)C Show InChI InChI=1S/C34H49NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-33(36)35-34-31(29(2)3)26-25-27-32(34)30(4)5/h6-7,9-10,12-13,15-16,18-19,21-22,25-27,29-30H,8,11,14,17,20,23-24,28H2,1-5H3,(H,35,36)/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+ | PDB
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| CHEMBL
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| n/a | n/a | 7.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Azwell Inc.
Curated by ChEMBL
| Assay Description
Compound was tested for inhibitory activity against ACAT from U937 microsome in human |
Bioorg Med Chem Lett 9: 2039-42 (1999)
BindingDB Entry DOI: 10.7270/Q2FF3RJJ |
More data for this
Ligand-Target Pair | |
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