BDBM50063239 CHEMBL161638::N-(2,6-Diisopropyl-phenyl)-2-phenyl-malonamic acid dodecyl ester
SMILES: CCCCCCCCCCCCOC(=O)C(C(=O)Nc1c(cccc1C(C)C)C(C)C)c1ccccc1
InChI Key: InChIKey=UPDIQEKNPVBXAI-UHFFFAOYSA-N
Data: 3 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Carboxylesterase 1 (Oryctolagus cuniculus (rabbit)) | BDBM50063239 (CHEMBL161638 | N-(2,6-Diisopropyl-phenyl)-2-phenyl...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Warner-Lambert Company Curated by ChEMBL | Assay Description Inhibition of Acyl coenzyme A:cholesterol acyltransferase by microsomal LAI assay | J Med Chem 41: 682-90 (1998) Article DOI: 10.1021/jm970560h BindingDB Entry DOI: 10.7270/Q28051R8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carboxylesterase 1 (Oryctolagus cuniculus (rabbit)) | BDBM50063239 (CHEMBL161638 | N-(2,6-Diisopropyl-phenyl)-2-phenyl...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Warner-Lambert Company Curated by ChEMBL | Assay Description Inhibition of Acyl coenzyme A:cholesterol acyltransferase by microsomal MAI2 assay | J Med Chem 41: 682-90 (1998) Article DOI: 10.1021/jm970560h BindingDB Entry DOI: 10.7270/Q28051R8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sterol O-acyltransferase, Soat (Rattus norvegicus) | BDBM50063239 (CHEMBL161638 | N-(2,6-Diisopropyl-phenyl)-2-phenyl...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Warner-Lambert Company Curated by ChEMBL | Assay Description In vitro Acyl coenzyme A:cholesterol acyltransferase inhibition in hepatic microsomes isolated from cholesterol-fed rats | J Med Chem 41: 682-90 (1998) Article DOI: 10.1021/jm970560h BindingDB Entry DOI: 10.7270/Q28051R8 | |||||||||||
More data for this Ligand-Target Pair |