BindingDB Reactant_set_id Ligand SMILES Ligand InChI Ligand InChI Key BindingDB MonomerID BindingDB Ligand Name Target Name Target Source Organism According to Curator or DataSource Ki (nM) IC50 (nM) Kd (nM) EC50 (nM) kon (M-1-s-1) koff (s-1) pH Temp (C) Curation/DataSource Article DOI BindingDB Entry DOI PMID PubChem AID Patent Number Authors Date of publication Date in BindingDB Institution Link to Ligand in BindingDB Link to Target in BindingDB Link to Ligand-Target Pair in BindingDB Ligand HET ID in PDB PDB ID(s) for Ligand-Target Complex PubChem CID PubChem SID ChEBI ID of Ligand ChEMBL ID of Ligand DrugBank ID of Ligand IUPHAR_GRAC ID of Ligand KEGG ID of Ligand ZINC ID of Ligand Number of Protein Chains in Target (>1 implies a multichain complex) BindingDB Target Chain Sequence 1 PDB ID(s) of Target Chain 1 UniProt (SwissProt) Recommended Name of Target Chain 1 UniProt (SwissProt) Entry Name of Target Chain 1 UniProt (SwissProt) Primary ID of Target Chain 1 UniProt (SwissProt) Secondary ID(s) of Target Chain 1 UniProt (SwissProt) Alternative ID(s) of Target Chain 1 UniProt (TrEMBL) Submitted Name of Target Chain 1 UniProt (TrEMBL) Entry Name of Target Chain 1 UniProt (TrEMBL) Primary ID of Target Chain 1 UniProt (TrEMBL) Secondary ID(s) of Target Chain 1 UniProt (TrEMBL) Alternative ID(s) of Target Chain 1 BindingDB Target Chain Sequence 2 PDB ID(s) of Target Chain 2 UniProt (SwissProt) Recommended Name of Target Chain 2 UniProt (SwissProt) Entry Name of Target Chain 2 UniProt (SwissProt) Primary ID of Target Chain 2 UniProt (SwissProt) Secondary ID(s) of Target Chain 2 UniProt (SwissProt) Alternative ID(s) of Target Chain 2 UniProt (TrEMBL) Submitted Name of Target Chain 2 UniProt (TrEMBL) Entry Name of Target Chain 2 UniProt (TrEMBL) Primary ID of Target Chain 2 UniProt (TrEMBL) Secondary ID(s) of Target Chain 2 UniProt (TrEMBL) Alternative ID(s) of Target Chain 2 BindingDB Target Chain Sequence 3 PDB ID(s) of Target Chain 3 UniProt (SwissProt) Recommended Name of Target Chain 3 UniProt (SwissProt) Entry Name of Target Chain 3 UniProt (SwissProt) Primary ID of Target Chain 3 UniProt (SwissProt) Secondary ID(s) of Target Chain 3 UniProt (SwissProt) Alternative ID(s) of Target Chain 3 UniProt (TrEMBL) Submitted Name of Target Chain 3 UniProt (TrEMBL) Entry Name of Target Chain 3 UniProt (TrEMBL) Primary ID of Target Chain 3 UniProt (TrEMBL) Secondary ID(s) of Target Chain 3 UniProt (TrEMBL) Alternative ID(s) of Target Chain 3 BindingDB Target Chain Sequence 4 PDB ID(s) of Target Chain 4 UniProt (SwissProt) Recommended Name of Target Chain 4 UniProt (SwissProt) Entry Name of Target Chain 4 UniProt (SwissProt) Primary ID of Target Chain 4 UniProt (SwissProt) Secondary ID(s) of Target Chain 4 UniProt (SwissProt) Alternative ID(s) of Target Chain 4 UniProt (TrEMBL) Submitted Name of Target Chain 4 UniProt (TrEMBL) Entry Name of Target Chain 4 UniProt (TrEMBL) Primary ID of Target Chain 4 UniProt (TrEMBL) Secondary ID(s) of Target Chain 4 UniProt (TrEMBL) Alternative ID(s) of Target Chain 4 BindingDB Target Chain Sequence 5 PDB ID(s) of Target Chain 5 UniProt (SwissProt) Recommended Name of Target Chain 5 UniProt (SwissProt) Entry Name of Target Chain 5 UniProt (SwissProt) Primary ID of Target Chain 5 UniProt (SwissProt) Secondary ID(s) of Target Chain 5 UniProt (SwissProt) Alternative ID(s) of Target Chain 5 UniProt (TrEMBL) Submitted Name of Target Chain 5 UniProt (TrEMBL) Entry Name of Target Chain 5 UniProt (TrEMBL) Primary ID of Target Chain 5 UniProt (TrEMBL) Secondary ID(s) of Target Chain 5 UniProt (TrEMBL) Alternative ID(s) of Target Chain 5 BindingDB Target Chain Sequence 6 PDB ID(s) of Target Chain 6 UniProt (SwissProt) Recommended Name of Target Chain 6 UniProt (SwissProt) Entry Name of Target Chain 6 UniProt (SwissProt) Primary ID of Target Chain 6 UniProt (SwissProt) Secondary ID(s) of Target Chain 6 UniProt (SwissProt) Alternative ID(s) of Target Chain 6 UniProt (TrEMBL) Submitted Name of Target Chain 6 UniProt (TrEMBL) Entry Name of Target Chain 6 UniProt (TrEMBL) Primary ID of Target Chain 6 UniProt (TrEMBL) Secondary ID(s) of Target Chain 6 UniProt (TrEMBL) Alternative ID(s) of Target Chain 6 BindingDB Target Chain Sequence 7 PDB ID(s) of Target Chain 7 UniProt (SwissProt) Recommended Name of Target Chain 7 UniProt (SwissProt) Entry Name of Target Chain 7 UniProt (SwissProt) Primary ID of Target Chain 7 UniProt (SwissProt) Secondary ID(s) of Target Chain 7 UniProt (SwissProt) Alternative ID(s) of Target Chain 7 UniProt (TrEMBL) Submitted Name of Target Chain 7 UniProt (TrEMBL) Entry Name of Target Chain 7 UniProt (TrEMBL) Primary ID of Target Chain 7 UniProt (TrEMBL) Secondary ID(s) of Target Chain 7 UniProt (TrEMBL) Alternative ID(s) of Target Chain 7 BindingDB Target Chain Sequence 8 PDB ID(s) of Target Chain 8 UniProt (SwissProt) Recommended Name of Target Chain 8 UniProt (SwissProt) Entry Name of Target Chain 8 UniProt (SwissProt) Primary ID of Target Chain 8 UniProt (SwissProt) Secondary ID(s) of Target Chain 8 UniProt (SwissProt) Alternative ID(s) of Target Chain 8 UniProt (TrEMBL) Submitted Name of Target Chain 8 UniProt (TrEMBL) Entry Name of Target Chain 8 UniProt (TrEMBL) Primary ID of Target Chain 8 UniProt (TrEMBL) Secondary ID(s) of Target Chain 8 UniProt (TrEMBL) Alternative ID(s) of Target Chain 8 BindingDB Target Chain Sequence 9 PDB ID(s) of Target Chain 9 UniProt (SwissProt) Recommended Name of Target Chain 9 UniProt (SwissProt) Entry Name of Target Chain 9 UniProt (SwissProt) Primary ID of Target Chain 9 UniProt (SwissProt) Secondary ID(s) of Target Chain 9 UniProt (SwissProt) Alternative ID(s) of Target Chain 9 UniProt (TrEMBL) Submitted Name of Target Chain 9 UniProt (TrEMBL) Entry Name of Target Chain 9 UniProt (TrEMBL) Primary ID of Target Chain 9 UniProt (TrEMBL) Secondary ID(s) of Target Chain 9 UniProt (TrEMBL) Alternative ID(s) of Target Chain 9 BindingDB Target Chain Sequence 10 PDB ID(s) of Target Chain 10 UniProt (SwissProt) Recommended Name of Target Chain 10 UniProt (SwissProt) Entry Name of Target Chain 10 UniProt (SwissProt) Primary ID of Target Chain 10 UniProt (SwissProt) Secondary ID(s) of Target Chain 10 UniProt (SwissProt) Alternative ID(s) of Target Chain 10 UniProt (TrEMBL) Submitted Name of Target Chain 10 UniProt (TrEMBL) Entry Name of Target Chain 10 UniProt (TrEMBL) Primary ID of Target Chain 10 UniProt (TrEMBL) Secondary ID(s) of Target Chain 10 UniProt (TrEMBL) Alternative ID(s) of Target Chain 10 BindingDB Target Chain Sequence 11 PDB ID(s) of Target Chain 11 UniProt (SwissProt) Recommended Name of Target Chain 11 UniProt (SwissProt) Entry Name of Target Chain 11 UniProt (SwissProt) Primary ID of Target Chain 11 UniProt (SwissProt) Secondary ID(s) of Target Chain 11 UniProt (SwissProt) Alternative ID(s) of Target Chain 11 UniProt (TrEMBL) Submitted Name of Target Chain 11 UniProt (TrEMBL) Entry Name of Target Chain 11 UniProt (TrEMBL) Primary ID of Target Chain 11 UniProt (TrEMBL) Secondary ID(s) of Target Chain 11 UniProt (TrEMBL) Alternative ID(s) of Target Chain 11 BindingDB Target Chain Sequence 12 PDB ID(s) of Target Chain 12 UniProt (SwissProt) Recommended Name of Target Chain 12 UniProt (SwissProt) Entry Name of Target Chain 12 UniProt (SwissProt) Primary ID of Target Chain 12 UniProt (SwissProt) Secondary ID(s) of Target Chain 12 UniProt (SwissProt) Alternative ID(s) of Target Chain 12 UniProt (TrEMBL) Submitted Name of Target Chain 12 UniProt (TrEMBL) Entry Name of Target Chain 12 UniProt (TrEMBL) Primary ID of Target Chain 12 UniProt (TrEMBL) Secondary ID(s) of Target Chain 12 UniProt (TrEMBL) Alternative ID(s) of Target Chain 12 BindingDB Target Chain Sequence 13 PDB ID(s) of Target Chain 13 UniProt (SwissProt) Recommended Name of Target Chain 13 UniProt (SwissProt) Entry Name of Target Chain 13 UniProt (SwissProt) Primary ID of Target Chain 13 UniProt (SwissProt) Secondary ID(s) of Target Chain 13 UniProt (SwissProt) Alternative ID(s) of Target Chain 13 UniProt (TrEMBL) Submitted Name of Target Chain 13 UniProt (TrEMBL) Entry Name of Target Chain 13 UniProt (TrEMBL) Primary ID of Target Chain 13 UniProt (TrEMBL) Secondary ID(s) of Target Chain 13 UniProt (TrEMBL) Alternative ID(s) of Target Chain 13 BindingDB Target Chain Sequence 14 PDB ID(s) of Target Chain 14 UniProt (SwissProt) Recommended Name of Target Chain 14 UniProt (SwissProt) Entry Name of Target Chain 14 UniProt (SwissProt) Primary ID of Target Chain 14 UniProt (SwissProt) Secondary ID(s) of Target Chain 14 UniProt (SwissProt) Alternative ID(s) of Target Chain 14 UniProt (TrEMBL) Submitted Name of Target Chain 14 UniProt (TrEMBL) Entry Name of Target Chain 14 UniProt (TrEMBL) Primary ID of Target Chain 14 UniProt (TrEMBL) Secondary ID(s) of Target Chain 14 UniProt (TrEMBL) Alternative ID(s) of Target Chain 14 BindingDB Target Chain Sequence 15 PDB ID(s) of Target Chain 15 UniProt (SwissProt) Recommended Name of Target Chain 15 UniProt (SwissProt) Entry Name of Target Chain 15 UniProt (SwissProt) Primary ID of Target Chain 15 UniProt (SwissProt) Secondary ID(s) of Target Chain 15 UniProt (SwissProt) Alternative ID(s) of Target Chain 15 UniProt (TrEMBL) Submitted Name of Target Chain 15 UniProt (TrEMBL) Entry Name of Target Chain 15 UniProt (TrEMBL) Primary ID of Target Chain 15 UniProt (TrEMBL) Secondary ID(s) of Target Chain 15 UniProt (TrEMBL) Alternative ID(s) of Target Chain 15 BindingDB Target Chain Sequence 16 PDB ID(s) of Target Chain 16 UniProt (SwissProt) Recommended Name of Target Chain 16 UniProt (SwissProt) Entry Name of Target Chain 16 UniProt (SwissProt) Primary ID of Target Chain 16 UniProt (SwissProt) Secondary ID(s) of Target Chain 16 UniProt (SwissProt) Alternative ID(s) of Target Chain 16 UniProt (TrEMBL) Submitted Name of Target Chain 16 UniProt (TrEMBL) Entry Name of Target Chain 16 UniProt (TrEMBL) Primary ID of Target Chain 16 UniProt (TrEMBL) Secondary ID(s) of Target Chain 16 UniProt (TrEMBL) Alternative ID(s) of Target Chain 16 BindingDB Target Chain Sequence 17 PDB ID(s) of Target Chain 17 UniProt (SwissProt) Recommended Name of Target Chain 17 UniProt (SwissProt) Entry Name of Target Chain 17 UniProt (SwissProt) Primary ID of Target Chain 17 UniProt (SwissProt) Secondary ID(s) of Target Chain 17 UniProt (SwissProt) Alternative ID(s) of Target Chain 17 UniProt (TrEMBL) Submitted Name of Target Chain 17 UniProt (TrEMBL) Entry Name of Target Chain 17 UniProt (TrEMBL) Primary ID of Target Chain 17 UniProt (TrEMBL) Secondary ID(s) of Target Chain 17 UniProt (TrEMBL) Alternative ID(s) of Target Chain 17 BindingDB Target Chain Sequence 18 PDB ID(s) of Target Chain 18 UniProt (SwissProt) Recommended Name of Target Chain 18 UniProt (SwissProt) Entry Name of Target Chain 18 UniProt (SwissProt) Primary ID of Target Chain 18 UniProt (SwissProt) Secondary ID(s) of Target Chain 18 UniProt (SwissProt) Alternative ID(s) of Target Chain 18 UniProt (TrEMBL) Submitted Name of Target Chain 18 UniProt (TrEMBL) Entry Name of Target Chain 18 UniProt (TrEMBL) Primary ID of Target Chain 18 UniProt (TrEMBL) Secondary ID(s) of Target Chain 18 UniProt (TrEMBL) Alternative ID(s) of Target Chain 18 BindingDB Target Chain Sequence 19 PDB ID(s) of Target Chain 19 UniProt (SwissProt) Recommended Name of Target Chain 19 UniProt (SwissProt) Entry Name of Target Chain 19 UniProt (SwissProt) Primary ID of Target Chain 19 UniProt (SwissProt) Secondary ID(s) of Target Chain 19 UniProt (SwissProt) Alternative ID(s) of Target Chain 19 UniProt (TrEMBL) Submitted Name of Target Chain 19 UniProt (TrEMBL) Entry Name of Target Chain 19 UniProt (TrEMBL) Primary ID of Target Chain 19 UniProt (TrEMBL) Secondary ID(s) of Target Chain 19 UniProt (TrEMBL) Alternative ID(s) of Target Chain 19 BindingDB Target Chain Sequence 20 PDB ID(s) of Target Chain 20 UniProt (SwissProt) Recommended Name of Target Chain 20 UniProt (SwissProt) Entry Name of Target Chain 20 UniProt (SwissProt) Primary ID of Target Chain 20 UniProt (SwissProt) Secondary ID(s) of Target Chain 20 UniProt (SwissProt) Alternative ID(s) of Target Chain 20 UniProt (TrEMBL) Submitted Name of Target Chain 20 UniProt (TrEMBL) Entry Name of Target Chain 20 UniProt (TrEMBL) Primary ID of Target Chain 20 UniProt (TrEMBL) Secondary ID(s) of Target Chain 20 UniProt (TrEMBL) Alternative ID(s) of Target Chain 20 BindingDB Target Chain Sequence 21 PDB ID(s) of Target Chain 21 UniProt (SwissProt) Recommended Name of Target Chain 21 UniProt (SwissProt) Entry Name of Target Chain 21 UniProt (SwissProt) Primary ID of Target Chain 21 UniProt (SwissProt) Secondary ID(s) of Target Chain 21 UniProt (SwissProt) Alternative ID(s) of Target Chain 21 UniProt (TrEMBL) Submitted Name of Target Chain 21 UniProt (TrEMBL) Entry Name of Target Chain 21 UniProt (TrEMBL) Primary ID of Target Chain 21 UniProt (TrEMBL) Secondary ID(s) of Target Chain 21 UniProt (TrEMBL) Alternative ID(s) of Target Chain 21 BindingDB Target Chain Sequence 22 PDB ID(s) of Target Chain 22 UniProt (SwissProt) Recommended Name of Target Chain 22 UniProt (SwissProt) Entry Name of Target Chain 22 UniProt (SwissProt) Primary ID of Target Chain 22 UniProt (SwissProt) Secondary ID(s) of Target Chain 22 UniProt (SwissProt) Alternative ID(s) of Target Chain 22 UniProt (TrEMBL) Submitted Name of Target Chain 22 UniProt (TrEMBL) Entry Name of Target Chain 22 UniProt (TrEMBL) Primary ID of Target Chain 22 UniProt (TrEMBL) Secondary ID(s) of Target Chain 22 UniProt (TrEMBL) Alternative ID(s) of Target Chain 22 BindingDB Target Chain Sequence 23 PDB ID(s) of Target Chain 23 UniProt (SwissProt) Recommended Name of Target Chain 23 UniProt (SwissProt) Entry Name of Target Chain 23 UniProt (SwissProt) Primary ID of Target Chain 23 UniProt (SwissProt) Secondary ID(s) of Target Chain 23 UniProt (SwissProt) Alternative ID(s) of Target Chain 23 UniProt (TrEMBL) Submitted Name of Target Chain 23 UniProt (TrEMBL) Entry Name of Target Chain 23 UniProt (TrEMBL) Primary ID of Target Chain 23 UniProt (TrEMBL) Secondary ID(s) of Target Chain 23 UniProt (TrEMBL) Alternative ID(s) of Target Chain 23 BindingDB Target Chain Sequence 24 PDB ID(s) of Target Chain 24 UniProt (SwissProt) Recommended Name of Target Chain 24 UniProt (SwissProt) Entry Name of Target Chain 24 UniProt (SwissProt) Primary ID of Target Chain 24 UniProt (SwissProt) Secondary ID(s) of Target Chain 24 UniProt (SwissProt) Alternative ID(s) of Target Chain 24 UniProt (TrEMBL) Submitted Name of Target Chain 24 UniProt (TrEMBL) Entry Name of Target Chain 24 UniProt (TrEMBL) Primary ID of Target Chain 24 UniProt (TrEMBL) Secondary ID(s) of Target Chain 24 UniProt (TrEMBL) Alternative ID(s) of Target Chain 24 BindingDB Target Chain Sequence 25 PDB ID(s) of Target Chain 25 UniProt (SwissProt) Recommended Name of Target Chain 25 UniProt (SwissProt) Entry Name of Target Chain 25 UniProt (SwissProt) Primary ID of Target Chain 25 UniProt (SwissProt) Secondary ID(s) of Target Chain 25 UniProt (SwissProt) Alternative ID(s) of Target Chain 25 UniProt (TrEMBL) Submitted Name of Target Chain 25 UniProt (TrEMBL) Entry Name of Target Chain 25 UniProt (TrEMBL) Primary ID of Target Chain 25 UniProt (TrEMBL) Secondary ID(s) of Target Chain 25 UniProt (TrEMBL) Alternative ID(s) of Target Chain 25 BindingDB Target Chain Sequence 26 PDB ID(s) of Target Chain 26 UniProt (SwissProt) Recommended Name of Target Chain 26 UniProt (SwissProt) Entry Name of Target Chain 26 UniProt (SwissProt) Primary ID of Target Chain 26 UniProt (SwissProt) Secondary ID(s) of Target Chain 26 UniProt (SwissProt) Alternative ID(s) of Target Chain 26 UniProt (TrEMBL) Submitted Name of Target Chain 26 UniProt (TrEMBL) Entry Name of Target Chain 26 UniProt (TrEMBL) Primary ID of Target Chain 26 UniProt (TrEMBL) Secondary ID(s) of Target Chain 26 UniProt (TrEMBL) Alternative ID(s) of Target Chain 26 BindingDB Target Chain Sequence 27 PDB ID(s) of Target Chain 27 UniProt (SwissProt) Recommended Name of Target Chain 27 UniProt (SwissProt) Entry Name of Target Chain 27 UniProt (SwissProt) Primary ID of Target Chain 27 UniProt (SwissProt) Secondary ID(s) of Target Chain 27 UniProt (SwissProt) Alternative ID(s) of Target Chain 27 UniProt (TrEMBL) Submitted Name of Target Chain 27 UniProt (TrEMBL) Entry Name of Target Chain 27 UniProt (TrEMBL) Primary ID of Target Chain 27 UniProt (TrEMBL) Secondary ID(s) of Target Chain 27 UniProt (TrEMBL) Alternative ID(s) of Target Chain 27 BindingDB Target Chain Sequence 28 PDB ID(s) of Target Chain 28 UniProt (SwissProt) Recommended Name of Target Chain 28 UniProt (SwissProt) Entry Name of Target Chain 28 UniProt (SwissProt) Primary ID of Target Chain 28 UniProt (SwissProt) Secondary ID(s) of Target Chain 28 UniProt (SwissProt) Alternative ID(s) of Target Chain 28 UniProt (TrEMBL) Submitted Name of Target Chain 28 UniProt (TrEMBL) Entry Name of Target Chain 28 UniProt (TrEMBL) Primary ID of Target Chain 28 UniProt (TrEMBL) Secondary ID(s) of Target Chain 28 UniProt (TrEMBL) Alternative ID(s) of Target Chain 28 BindingDB Target Chain Sequence 29 PDB ID(s) of Target Chain 29 UniProt (SwissProt) Recommended Name of Target Chain 29 UniProt (SwissProt) Entry Name of Target Chain 29 UniProt (SwissProt) Primary ID of Target Chain 29 UniProt (SwissProt) Secondary ID(s) of Target Chain 29 UniProt (SwissProt) Alternative ID(s) of Target Chain 29 UniProt (TrEMBL) Submitted Name of Target Chain 29 UniProt (TrEMBL) Entry Name of Target Chain 29 UniProt (TrEMBL) Primary ID of Target Chain 29 UniProt (TrEMBL) Secondary ID(s) of Target Chain 29 UniProt (TrEMBL) Alternative ID(s) of Target Chain 29 BindingDB Target Chain Sequence 30 PDB ID(s) of Target Chain 30 UniProt (SwissProt) Recommended Name of Target Chain 30 UniProt (SwissProt) Entry Name of Target Chain 30 UniProt (SwissProt) Primary ID of Target Chain 30 UniProt (SwissProt) Secondary ID(s) of Target Chain 30 UniProt (SwissProt) Alternative ID(s) of Target Chain 30 UniProt (TrEMBL) Submitted Name of Target Chain 30 UniProt (TrEMBL) Entry Name of Target Chain 30 UniProt (TrEMBL) Primary ID of Target Chain 30 UniProt (TrEMBL) Secondary ID(s) of Target Chain 30 UniProt (TrEMBL) Alternative ID(s) of Target Chain 30 BindingDB Target Chain Sequence 31 PDB ID(s) of Target Chain 31 UniProt (SwissProt) Recommended Name of Target Chain 31 UniProt (SwissProt) Entry Name of Target Chain 31 UniProt (SwissProt) Primary ID of Target Chain 31 UniProt (SwissProt) Secondary ID(s) of Target Chain 31 UniProt (SwissProt) Alternative ID(s) of Target Chain 31 UniProt (TrEMBL) Submitted Name of Target Chain 31 UniProt (TrEMBL) Entry Name of Target Chain 31 UniProt (TrEMBL) Primary ID of Target Chain 31 UniProt (TrEMBL) Secondary ID(s) of Target Chain 31 UniProt (TrEMBL) Alternative ID(s) of Target Chain 31 BindingDB Target Chain Sequence 32 PDB ID(s) of Target Chain 32 UniProt (SwissProt) Recommended Name of Target Chain 32 UniProt (SwissProt) Entry Name of Target Chain 32 UniProt (SwissProt) Primary ID of Target Chain 32 UniProt (SwissProt) Secondary ID(s) of Target Chain 32 UniProt (SwissProt) Alternative ID(s) of Target Chain 32 UniProt (TrEMBL) Submitted Name of Target Chain 32 UniProt (TrEMBL) Entry Name of Target Chain 32 UniProt (TrEMBL) Primary ID of Target Chain 32 UniProt (TrEMBL) Secondary ID(s) of Target Chain 32 UniProt (TrEMBL) Alternative ID(s) of Target Chain 32 BindingDB Target Chain Sequence 33 PDB ID(s) of Target Chain 33 UniProt (SwissProt) Recommended Name of Target Chain 33 UniProt (SwissProt) Entry Name of Target Chain 33 UniProt (SwissProt) Primary ID of Target Chain 33 UniProt (SwissProt) Secondary ID(s) of Target Chain 33 UniProt (SwissProt) Alternative ID(s) of Target Chain 33 UniProt (TrEMBL) Submitted Name of Target Chain 33 UniProt (TrEMBL) Entry Name of Target Chain 33 UniProt (TrEMBL) Primary ID of Target Chain 33 UniProt (TrEMBL) Secondary ID(s) of Target Chain 33 UniProt (TrEMBL) Alternative ID(s) of Target Chain 33 BindingDB Target Chain Sequence 34 PDB ID(s) of Target Chain 34 UniProt (SwissProt) Recommended Name of Target Chain 34 UniProt (SwissProt) Entry Name of Target Chain 34 UniProt (SwissProt) Primary ID of Target Chain 34 UniProt (SwissProt) Secondary ID(s) of Target Chain 34 UniProt (SwissProt) Alternative ID(s) of Target Chain 34 UniProt (TrEMBL) Submitted Name of Target Chain 34 UniProt (TrEMBL) Entry Name of Target Chain 34 UniProt (TrEMBL) Primary ID of Target Chain 34 UniProt (TrEMBL) Secondary ID(s) of Target Chain 34 UniProt (TrEMBL) Alternative ID(s) of Target Chain 34 BindingDB Target Chain Sequence 35 PDB ID(s) of Target Chain 35 UniProt (SwissProt) Recommended Name of Target Chain 35 UniProt (SwissProt) Entry Name of Target Chain 35 UniProt (SwissProt) Primary ID of Target Chain 35 UniProt (SwissProt) Secondary ID(s) of Target Chain 35 UniProt (SwissProt) Alternative ID(s) of Target Chain 35 UniProt (TrEMBL) Submitted Name of Target Chain 35 UniProt (TrEMBL) Entry Name of Target Chain 35 UniProt (TrEMBL) Primary ID of Target Chain 35 UniProt (TrEMBL) Secondary ID(s) of Target Chain 35 UniProt (TrEMBL) Alternative ID(s) of Target Chain 35 BindingDB Target Chain Sequence 36 PDB ID(s) of Target Chain 36 UniProt (SwissProt) Recommended Name of Target Chain 36 UniProt (SwissProt) Entry Name of Target Chain 36 UniProt (SwissProt) Primary ID of Target Chain 36 UniProt (SwissProt) Secondary ID(s) of Target Chain 36 UniProt (SwissProt) Alternative ID(s) of Target Chain 36 UniProt (TrEMBL) Submitted Name of Target Chain 36 UniProt (TrEMBL) Entry Name of Target Chain 36 UniProt (TrEMBL) Primary ID of Target Chain 36 UniProt (TrEMBL) Secondary ID(s) of Target Chain 36 UniProt (TrEMBL) Alternative ID(s) of Target Chain 36 BindingDB Target Chain Sequence 37 PDB ID(s) of Target Chain 37 UniProt (SwissProt) Recommended Name of Target Chain 37 UniProt (SwissProt) Entry Name of Target Chain 37 UniProt (SwissProt) Primary ID of Target Chain 37 UniProt (SwissProt) Secondary ID(s) of Target Chain 37 UniProt (SwissProt) Alternative ID(s) of Target Chain 37 UniProt (TrEMBL) Submitted Name of Target Chain 37 UniProt (TrEMBL) Entry Name of Target Chain 37 UniProt (TrEMBL) Primary ID of Target Chain 37 UniProt (TrEMBL) Secondary ID(s) of Target Chain 37 UniProt (TrEMBL) Alternative ID(s) of Target Chain 37 BindingDB Target Chain Sequence 38 PDB ID(s) of Target Chain 38 UniProt (SwissProt) Recommended Name of Target Chain 38 UniProt (SwissProt) Entry Name of Target Chain 38 UniProt (SwissProt) Primary ID of Target Chain 38 UniProt (SwissProt) Secondary ID(s) of Target Chain 38 UniProt (SwissProt) Alternative ID(s) of Target Chain 38 UniProt (TrEMBL) Submitted Name of Target Chain 38 UniProt (TrEMBL) Entry Name of Target Chain 38 UniProt (TrEMBL) Primary ID of Target Chain 38 UniProt (TrEMBL) Secondary ID(s) of Target Chain 38 UniProt (TrEMBL) Alternative ID(s) of Target Chain 38 BindingDB Target Chain Sequence 39 PDB ID(s) of Target Chain 39 UniProt (SwissProt) Recommended Name of Target Chain 39 UniProt (SwissProt) Entry Name of Target Chain 39 UniProt (SwissProt) Primary ID of Target Chain 39 UniProt (SwissProt) Secondary ID(s) of Target Chain 39 UniProt (SwissProt) Alternative ID(s) of Target Chain 39 UniProt (TrEMBL) Submitted Name of Target Chain 39 UniProt (TrEMBL) Entry Name of Target Chain 39 UniProt (TrEMBL) Primary ID of Target Chain 39 UniProt (TrEMBL) Secondary ID(s) of Target Chain 39 UniProt (TrEMBL) Alternative ID(s) of Target Chain 39 BindingDB Target Chain Sequence 40 PDB ID(s) of Target Chain 40 UniProt (SwissProt) Recommended Name of Target Chain 40 UniProt (SwissProt) Entry Name of Target Chain 40 UniProt (SwissProt) Primary ID of Target Chain 40 UniProt (SwissProt) Secondary ID(s) of Target Chain 40 UniProt (SwissProt) Alternative ID(s) of Target Chain 40 UniProt (TrEMBL) Submitted Name of Target Chain 40 UniProt (TrEMBL) Entry Name of Target Chain 40 UniProt (TrEMBL) Primary ID of Target Chain 40 UniProt (TrEMBL) Secondary ID(s) of Target Chain 40 UniProt (TrEMBL) Alternative ID(s) of Target Chain 40 BindingDB Target Chain Sequence 41 PDB ID(s) of Target Chain 41 UniProt (SwissProt) Recommended Name of Target Chain 41 UniProt (SwissProt) Entry Name of Target Chain 41 UniProt (SwissProt) Primary ID of Target Chain 41 UniProt (SwissProt) Secondary ID(s) of Target Chain 41 UniProt (SwissProt) Alternative ID(s) of Target Chain 41 UniProt (TrEMBL) Submitted Name of Target Chain 41 UniProt (TrEMBL) Entry Name of Target Chain 41 UniProt (TrEMBL) Primary ID of Target Chain 41 UniProt (TrEMBL) Secondary ID(s) of Target Chain 41 UniProt (TrEMBL) Alternative ID(s) of Target Chain 41 BindingDB Target Chain Sequence 42 PDB ID(s) of Target Chain 42 UniProt (SwissProt) Recommended Name of Target Chain 42 UniProt (SwissProt) Entry Name of Target Chain 42 UniProt (SwissProt) Primary ID of Target Chain 42 UniProt (SwissProt) Secondary ID(s) of Target Chain 42 UniProt (SwissProt) Alternative ID(s) of Target Chain 42 UniProt (TrEMBL) Submitted Name of Target Chain 42 UniProt (TrEMBL) Entry Name of Target Chain 42 UniProt (TrEMBL) Primary ID of Target Chain 42 UniProt (TrEMBL) Secondary ID(s) of Target Chain 42 UniProt (TrEMBL) Alternative ID(s) of Target Chain 42 BindingDB Target Chain Sequence 43 PDB ID(s) of Target Chain 43 UniProt (SwissProt) Recommended Name of Target Chain 43 UniProt (SwissProt) Entry Name of Target Chain 43 UniProt (SwissProt) Primary ID of Target Chain 43 UniProt (SwissProt) Secondary ID(s) of Target Chain 43 UniProt (SwissProt) Alternative ID(s) of Target Chain 43 UniProt (TrEMBL) Submitted Name of Target Chain 43 UniProt (TrEMBL) Entry Name of Target Chain 43 UniProt (TrEMBL) Primary ID of Target Chain 43 UniProt (TrEMBL) Secondary ID(s) of Target Chain 43 UniProt (TrEMBL) Alternative ID(s) of Target Chain 43 BindingDB Target Chain Sequence 44 PDB ID(s) of Target Chain 44 UniProt (SwissProt) Recommended Name of Target Chain 44 UniProt (SwissProt) Entry Name of Target Chain 44 UniProt (SwissProt) Primary ID of Target Chain 44 UniProt (SwissProt) Secondary ID(s) of Target Chain 44 UniProt (SwissProt) Alternative ID(s) of Target Chain 44 UniProt (TrEMBL) Submitted Name of Target Chain 44 UniProt (TrEMBL) Entry Name of Target Chain 44 UniProt (TrEMBL) Primary ID of Target Chain 44 UniProt (TrEMBL) Secondary ID(s) of Target Chain 44 UniProt (TrEMBL) Alternative ID(s) of Target Chain 44 BindingDB Target Chain Sequence 45 PDB ID(s) of Target Chain 45 UniProt (SwissProt) Recommended Name of Target Chain 45 UniProt (SwissProt) Entry Name of Target Chain 45 UniProt (SwissProt) Primary ID of Target Chain 45 UniProt (SwissProt) Secondary ID(s) of Target Chain 45 UniProt (SwissProt) Alternative ID(s) of Target Chain 45 UniProt (TrEMBL) Submitted Name of Target Chain 45 UniProt (TrEMBL) Entry Name of Target Chain 45 UniProt (TrEMBL) Primary ID of Target Chain 45 UniProt (TrEMBL) Secondary ID(s) of Target Chain 45 UniProt (TrEMBL) Alternative ID(s) of Target Chain 45 BindingDB Target Chain Sequence 46 PDB ID(s) of Target Chain 46 UniProt (SwissProt) Recommended Name of Target Chain 46 UniProt (SwissProt) Entry Name of Target Chain 46 UniProt (SwissProt) Primary ID of Target Chain 46 UniProt (SwissProt) Secondary ID(s) of Target Chain 46 UniProt (SwissProt) Alternative ID(s) of Target Chain 46 UniProt (TrEMBL) Submitted Name of Target Chain 46 UniProt (TrEMBL) Entry Name of Target Chain 46 UniProt (TrEMBL) Primary ID of Target Chain 46 UniProt (TrEMBL) Secondary ID(s) of Target Chain 46 UniProt (TrEMBL) Alternative ID(s) of Target Chain 46 BindingDB Target Chain Sequence 47 PDB ID(s) of Target Chain 47 UniProt (SwissProt) Recommended Name of Target Chain 47 UniProt (SwissProt) Entry Name of Target Chain 47 UniProt (SwissProt) Primary ID of Target Chain 47 UniProt (SwissProt) Secondary ID(s) of Target Chain 47 UniProt (SwissProt) Alternative ID(s) of Target Chain 47 UniProt (TrEMBL) Submitted Name of Target Chain 47 UniProt (TrEMBL) Entry Name of Target Chain 47 UniProt (TrEMBL) Primary ID of Target Chain 47 UniProt (TrEMBL) Secondary ID(s) of Target Chain 47 UniProt (TrEMBL) Alternative ID(s) of Target Chain 47 BindingDB Target Chain Sequence 48 PDB ID(s) of Target Chain 48 UniProt (SwissProt) Recommended Name of Target Chain 48 UniProt (SwissProt) Entry Name of Target Chain 48 UniProt (SwissProt) Primary ID of Target Chain 48 UniProt (SwissProt) Secondary ID(s) of Target Chain 48 UniProt (SwissProt) Alternative ID(s) of Target Chain 48 UniProt (TrEMBL) Submitted Name of Target Chain 48 UniProt (TrEMBL) Entry Name of Target Chain 48 UniProt (TrEMBL) Primary ID of Target Chain 48 UniProt (TrEMBL) Secondary ID(s) of Target Chain 48 UniProt (TrEMBL) Alternative ID(s) of Target Chain 48 BindingDB Target Chain Sequence 49 PDB ID(s) of Target Chain 49 UniProt (SwissProt) Recommended Name of Target Chain 49 UniProt (SwissProt) Entry Name of Target Chain 49 UniProt (SwissProt) Primary ID of Target Chain 49 UniProt (SwissProt) Secondary ID(s) of Target Chain 49 UniProt (SwissProt) Alternative ID(s) of Target Chain 49 UniProt (TrEMBL) Submitted Name of Target Chain 49 UniProt (TrEMBL) Entry Name of Target Chain 49 UniProt (TrEMBL) Primary ID of Target Chain 49 UniProt (TrEMBL) Secondary ID(s) of Target Chain 49 UniProt (TrEMBL) Alternative ID(s) of Target Chain 49 BindingDB Target Chain Sequence 50 PDB ID(s) of Target Chain 50 UniProt (SwissProt) Recommended Name of Target Chain 50 UniProt (SwissProt) Entry Name of Target Chain 50 UniProt (SwissProt) Primary ID of Target Chain 50 UniProt (SwissProt) Secondary ID(s) of Target Chain 50 UniProt (SwissProt) Alternative ID(s) of Target Chain 50 UniProt (TrEMBL) Submitted Name of Target Chain 50 UniProt (TrEMBL) Entry Name of Target Chain 50 UniProt (TrEMBL) Primary ID of Target Chain 50 UniProt (TrEMBL) Secondary ID(s) of Target Chain 50 UniProt (TrEMBL) Alternative ID(s) of Target Chain 50 50035546 CC(C)c1cccc(c1NC(=O)NCC2(CCCC2)c3ccc(cc3)N(C)C)C(C)C InChI=1S/C27H39N3O/c1-19(2)23-10-9-11-24(20(3)4)25(23)29-26(31)28-18-27(16-7-8-17-27)21-12-14-22(15-13-21)30(5)6/h9-15,19-20H,7-8,16-18H2,1-6H3,(H2,28,29,31) PKKNCEXEVUFFFI-UHFFFAOYSA-N 50041735 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-dimethylamino-phenyl)-cyclopentylmethyl]-urea; hydrochloride::CHEMBL46423::CHEMBL542103 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 52 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041735 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041735&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search ROV 6VUM,7N6R 131679 103973425 CHEMBL542103CHEMBL46423 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035547 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(Cl)cc1 InChI=1S/C25H33ClN2O/c1-17(2)21-8-7-9-22(18(3)4)23(21)28-24(29)27-16-25(14-5-6-15-25)19-10-12-20(26)13-11-19/h7-13,17-18H,5-6,14-16H2,1-4H3,(H2,27,28,29) WFPYGTHGMKRIFV-UHFFFAOYSA-N 50041759 1-[1-(4-Chloro-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL46793 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 32 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041759 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041759&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10409469 103973449 CHEMBL46793 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035548 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CN(C)C)c1 InChI=1S/C28H41N3O/c1-20(2)24-13-10-14-25(21(3)4)26(24)30-27(32)29-19-28(15-7-8-16-28)23-12-9-11-22(17-23)18-31(5)6/h9-14,17,20-21H,7-8,15-16,18-19H2,1-6H3,(H2,29,30,32) CAFXWIACTUBFTP-UHFFFAOYSA-N 50041724 1-(2,6-Diisopropyl-phenyl)-3-[1-(3-dimethylaminomethyl-phenyl)-cyclopentylmethyl]-urea; hydrochloride::CHEMBL42236::CHEMBL545661 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 67 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041724 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041724&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10455652 103973414 CHEMBL545661CHEMBL42236 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035549 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(c1)[N+]([O-])=O InChI=1S/C25H33N3O3/c1-17(2)21-11-8-12-22(18(3)4)23(21)27-24(29)26-16-25(13-5-6-14-25)19-9-7-10-20(15-19)28(30)31/h7-12,15,17-18H,5-6,13-14,16H2,1-4H3,(H2,26,27,29) JZKXWBCWCHRJQL-UHFFFAOYSA-N 50041756 1-(2,6-Diisopropyl-phenyl)-3-[1-(3-nitro-phenyl)-cyclopentylmethyl]-urea::CHEMBL42186 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 51 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041756 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041756&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10364998 103973446 CHEMBL42186 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035550 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccccc1[N+]([O-])=O InChI=1S/C25H33N3O3/c1-17(2)19-10-9-11-20(18(3)4)23(19)27-24(29)26-16-25(14-7-8-15-25)21-12-5-6-13-22(21)28(30)31/h5-6,9-13,17-18H,7-8,14-16H2,1-4H3,(H2,26,27,29) IVRSWIBLDMJGFQ-UHFFFAOYSA-N 50041722 1-(2,6-Diisopropyl-phenyl)-3-[1-(2-nitro-phenyl)-cyclopentylmethyl]-urea::CHEMBL433470 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 27 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041722 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041722&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10410062 103973412 CHEMBL433470 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035551 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccccc1 InChI=1S/C25H34N2O/c1-18(2)21-13-10-14-22(19(3)4)23(21)27-24(28)26-17-25(15-8-9-16-25)20-11-6-5-7-12-20/h5-7,10-14,18-19H,8-9,15-17H2,1-4H3,(H2,26,27,28) YDMKLNVDRGIRBS-UHFFFAOYSA-N 50038526 1-(2,6-Diisopropyl-phenyl)-3-(1-phenyl-cyclopentylmethyl)-urea::PD-129337::CHEMBL296055 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 17 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038526 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038526&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 9929678 103945826 CHEMBL296055 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035552 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(cc1C(F)(F)F)N(C)C InChI=1S/C28H38F3N3O/c1-18(2)21-10-9-11-22(19(3)4)25(21)33-26(35)32-17-27(14-7-8-15-27)23-13-12-20(34(5)6)16-24(23)28(29,30)31/h9-13,16,18-19H,7-8,14-15,17H2,1-6H3,(H2,32,33,35) NKORAYXECOPIKO-UHFFFAOYSA-N 50041760 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-dimethylamino-2-trifluoromethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL296056 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 50 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041760 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041760&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10368276 103973450 CHEMBL296056 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035553 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CC#N)c1 InChI=1S/C27H35N3O/c1-19(2)23-11-8-12-24(20(3)4)25(23)30-26(31)29-18-27(14-5-6-15-27)22-10-7-9-21(17-22)13-16-28/h7-12,17,19-20H,5-6,13-15,18H2,1-4H3,(H2,29,30,31) ONLCSSIFYPRBEL-UHFFFAOYSA-N 50041744 1-[1-(3-Cyanomethyl-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL43010 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 24 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041744 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041744&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10341923 103973434 CHEMBL43010 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035554 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(OCc2ccccc2)cc1 InChI=1S/C32H40N2O2/c1-23(2)28-13-10-14-29(24(3)4)30(28)34-31(35)33-22-32(19-8-9-20-32)26-15-17-27(18-16-26)36-21-25-11-6-5-7-12-25/h5-7,10-18,23-24H,8-9,19-22H2,1-4H3,(H2,33,34,35) TWZGXCLQIYMEEK-UHFFFAOYSA-N 50041742 1-[1-(4-Benzyloxy-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL46729 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 34 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041742 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041742&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 15172069 103973432 CHEMBL46729 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035555 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(N)c1 InChI=1S/C25H35N3O/c1-17(2)21-11-8-12-22(18(3)4)23(21)28-24(29)27-16-25(13-5-6-14-25)19-9-7-10-20(26)15-19/h7-12,15,17-18H,5-6,13-14,16,26H2,1-4H3,(H2,27,28,29) CXMGUSWNOXOLNT-UHFFFAOYSA-N 50041761 1-[1-(3-Amino-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL296124 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 21 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041761 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041761&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10069171 103973451 CHEMBL296124 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035556 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(N)cc1 InChI=1S/C25H35N3O/c1-17(2)21-8-7-9-22(18(3)4)23(21)28-24(29)27-16-25(14-5-6-15-25)19-10-12-20(26)13-11-19/h7-13,17-18H,5-6,14-16,26H2,1-4H3,(H2,27,28,29) LPATYTQUGBMLKS-UHFFFAOYSA-N 50041725 1-[1-(4-Amino-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL432497 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 29 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041725 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041725&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10046111 103973415 CHEMBL432497 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035593 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(C)cc1 InChI=1S/C26H36N2O/c1-18(2)22-9-8-10-23(19(3)4)24(22)28-25(29)27-17-26(15-6-7-16-26)21-13-11-20(5)12-14-21/h8-14,18-19H,6-7,15-17H2,1-5H3,(H2,27,28,29) IMYYOGPUNCSBLF-UHFFFAOYSA-N 50041743 1-(2,6-Diisopropyl-phenyl)-3-(1-p-tolyl-cyclopentylmethyl)-urea::CHEMBL296892 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 25 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041743 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041743&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10000614 103973433 CHEMBL296892 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035594 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(cc1)N(CCO)CCO InChI=1S/C29H43N3O3/c1-21(2)25-8-7-9-26(22(3)4)27(25)31-28(35)30-20-29(14-5-6-15-29)23-10-12-24(13-11-23)32(16-18-33)17-19-34/h7-13,21-22,33-34H,5-6,14-20H2,1-4H3,(H2,30,31,35) YGFPCFVUUSLJRZ-UHFFFAOYSA-N 50041736 1-(1-{4-[Bis-(2-hydroxy-ethyl)-amino]-phenyl}-cyclopentylmethyl)-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL46534 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 21 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041736 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041736&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10073958 103973426 CHEMBL46534 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035595 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(cc1)C(F)(F)F InChI=1S/C26H33F3N2O/c1-17(2)21-8-7-9-22(18(3)4)23(21)31-24(32)30-16-25(14-5-6-15-25)19-10-12-20(13-11-19)26(27,28)29/h7-13,17-18H,5-6,14-16H2,1-4H3,(H2,30,31,32) ASAHGMWBMFBXLP-UHFFFAOYSA-N 50041769 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-trifluoromethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL43499 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 66 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041769 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041769&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10478748 103973459 CHEMBL43499 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035596 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CN(CCOC(C)=O)CCOC(C)=O)c1 InChI=1S/C34H49N3O5/c1-24(2)30-13-10-14-31(25(3)4)32(30)36-33(40)35-23-34(15-7-8-16-34)29-12-9-11-28(21-29)22-37(17-19-41-26(5)38)18-20-42-27(6)39/h9-14,21,24-25H,7-8,15-20,22-23H2,1-6H3,(H2,35,36,40) LVXCRCBVLHOUPU-UHFFFAOYSA-N 50041734 Acetic acid 2-[(2-acetoxy-ethyl)-(3-{1-[3-(2,6-diisopropyl-phenyl)-ureidomethyl]-cyclopentyl}-benzyl)-amino]-ethyl ester::CHEMBL294984 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 33 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041734 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041734&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10460849 103973424 CHEMBL294984 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035597 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(Br)cc1 InChI=1S/C25H33BrN2O/c1-17(2)21-8-7-9-22(18(3)4)23(21)28-24(29)27-16-25(14-5-6-15-25)19-10-12-20(26)13-11-19/h7-13,17-18H,5-6,14-16H2,1-4H3,(H2,27,28,29) XUKUHTGQSQWJAP-UHFFFAOYSA-N 50041739 1-[1-(4-Bromo-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL45377 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 29 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041739 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041739&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10095622 103973429 CHEMBL45377 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035598 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(cc1)C(C)(C)C InChI=1S/C29H42N2O/c1-20(2)24-11-10-12-25(21(3)4)26(24)31-27(32)30-19-29(17-8-9-18-29)23-15-13-22(14-16-23)28(5,6)7/h10-16,20-21H,8-9,17-19H2,1-7H3,(H2,30,31,32) KFVWPUAUQLMHOM-UHFFFAOYSA-N 50041765 1-[1-(4-tert-Butyl-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL295230 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 63 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041765 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041765&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10320749 103973455 CHEMBL295230 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035599 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(CO)cc1 InChI=1S/C26H36N2O2/c1-18(2)22-8-7-9-23(19(3)4)24(22)28-25(30)27-17-26(14-5-6-15-26)21-12-10-20(16-29)11-13-21/h7-13,18-19,29H,5-6,14-17H2,1-4H3,(H2,27,28,30) HOVBKQVTAZGTHJ-UHFFFAOYSA-N 50041758 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-hydroxymethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL44590 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 26 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041758 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041758&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10476581 103973448 CHEMBL44590 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035600 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CO)c1 InChI=1S/C26H36N2O2/c1-18(2)22-11-8-12-23(19(3)4)24(22)28-25(30)27-17-26(13-5-6-14-26)21-10-7-9-20(15-21)16-29/h7-12,15,18-19,29H,5-6,13-14,16-17H2,1-4H3,(H2,27,28,30) HRZHWTXSAHSFNW-UHFFFAOYSA-N 50041738 1-(2,6-Diisopropyl-phenyl)-3-[1-(3-hydroxymethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL46676 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 15 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041738 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041738&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10341425 103973428 CHEMBL46676 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035601 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(cc1)C(O)=O InChI=1S/C26H34N2O3/c1-17(2)21-8-7-9-22(18(3)4)23(21)28-25(31)27-16-26(14-5-6-15-26)20-12-10-19(11-13-20)24(29)30/h7-13,17-18H,5-6,14-16H2,1-4H3,(H,29,30)(H2,27,28,31) UYFNGGVKYQPLPC-UHFFFAOYSA-N 50041762 4-{1-[3-(2,6-Diisopropyl-phenyl)-ureidomethyl]-cyclopentyl}-benzoic acid::CHEMBL298479 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 3100 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041762 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041762&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10342202 103973452 CHEMBL298479 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035602 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(c1)C(O)=O InChI=1S/C26H34N2O3/c1-17(2)21-11-8-12-22(18(3)4)23(21)28-25(31)27-16-26(13-5-6-14-26)20-10-7-9-19(15-20)24(29)30/h7-12,15,17-18H,5-6,13-14,16H2,1-4H3,(H,29,30)(H2,27,28,31) VIZNMUQTEJNNSG-UHFFFAOYSA-N 50041728 3-{1-[3-(2,6-Diisopropyl-phenyl)-ureidomethyl]-cyclopentyl}-benzoic acid::CHEMBL433472 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 620 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041728 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041728&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10432385 103973418 CHEMBL433472 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035603 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(NCCO)cc1 InChI=1S/C27H39N3O2/c1-19(2)23-8-7-9-24(20(3)4)25(23)30-26(32)29-18-27(14-5-6-15-27)21-10-12-22(13-11-21)28-16-17-31/h7-13,19-20,28,31H,5-6,14-18H2,1-4H3,(H2,29,30,32) PTSZSXZEORNOSV-UHFFFAOYSA-N 50041745 1-(2,6-Diisopropyl-phenyl)-3-{1-[4-(2-hydroxy-ethylamino)-phenyl]-cyclopentylmethyl}-urea::CHEMBL296469 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 25 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041745 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041745&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10455770 103973435 CHEMBL296469 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035604 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CN(CCO)CCO)c1 InChI=1S/C30H45N3O3/c1-22(2)26-11-8-12-27(23(3)4)28(26)32-29(36)31-21-30(13-5-6-14-30)25-10-7-9-24(19-25)20-33(15-17-34)16-18-35/h7-12,19,22-23,34-35H,5-6,13-18,20-21H2,1-4H3,(H2,31,32,36) SAKLOFOGXYWUIQ-UHFFFAOYSA-N 50041732 1-[1-(3-{[Bis-(2-hydroxy-ethyl)-amino]-methyl}-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL44435 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 47 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041732 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041732&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10255249 103973422 CHEMBL44435 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035605 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F InChI=1S/C27H32F6N2O/c1-16(2)21-8-7-9-22(17(3)4)23(21)35-24(36)34-15-25(10-5-6-11-25)18-12-19(26(28,29)30)14-20(13-18)27(31,32)33/h7-9,12-14,16-17H,5-6,10-11,15H2,1-4H3,(H2,34,35,36) BQJKEPPHUHHTIH-UHFFFAOYSA-N 50041730 1-[1-(3,5-Bis-trifluoromethyl-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL416448 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 57 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041730 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041730&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10481580 103973420 CHEMBL416448 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035606 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccccc1C(F)(F)F InChI=1S/C26H33F3N2O/c1-17(2)19-10-9-11-20(18(3)4)23(19)31-24(32)30-16-25(14-7-8-15-25)21-12-5-6-13-22(21)26(27,28)29/h5-6,9-13,17-18H,7-8,14-16H2,1-4H3,(H2,30,31,32) UOFGIKAFHLBHJU-UHFFFAOYSA-N 50041767 1-(2,6-Diisopropyl-phenyl)-3-[1-(2-trifluoromethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL295147 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 18 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041767 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041767&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10366299 103973457 CHEMBL295147 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035607 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1c(C)cc(C)cc1C InChI=1S/C28H40N2O/c1-18(2)23-11-10-12-24(19(3)4)26(23)30-27(31)29-17-28(13-8-9-14-28)25-21(6)15-20(5)16-22(25)7/h10-12,15-16,18-19H,8-9,13-14,17H2,1-7H3,(H2,29,30,31) PSHNBGFYCZLGJR-UHFFFAOYSA-N 50041727 1-(2,6-Diisopropyl-phenyl)-3-[1-(2,4,6-trimethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL42655 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 56 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041727 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041727&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10070780 103973417 CHEMBL42655 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035608 CCCCN(CCCC)Cc1cccc(c1)C1(CNC(=O)Nc2c(cccc2C(C)C)C(C)C)CCCC1 InChI=1S/C34H53N3O/c1-7-9-21-37(22-10-8-2)24-28-15-13-16-29(23-28)34(19-11-12-20-34)25-35-33(38)36-32-30(26(3)4)17-14-18-31(32)27(5)6/h13-18,23,26-27H,7-12,19-22,24-25H2,1-6H3,(H2,35,36,38) ZRZAQUNJJMKXBC-UHFFFAOYSA-N 50041729 1-[1-(3-Dibutylaminomethyl-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL43252 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 16 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041729 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041729&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10436690 103973419 CHEMBL43252 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035609 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(C)cc1C InChI=1S/C27H38N2O/c1-18(2)22-10-9-11-23(19(3)4)25(22)29-26(30)28-17-27(14-7-8-15-27)24-13-12-20(5)16-21(24)6/h9-13,16,18-19H,7-8,14-15,17H2,1-6H3,(H2,28,29,30) AQVVAYORIURKLH-UHFFFAOYSA-N 50041755 1-(2,6-Diisopropyl-phenyl)-3-[1-(2,4-dimethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL46645 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 50 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041755 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041755&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10363993 103973445 CHEMBL46645 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035610 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CN2CCOCC2)c1 InChI=1S/C30H43N3O2/c1-22(2)26-11-8-12-27(23(3)4)28(26)32-29(34)31-21-30(13-5-6-14-30)25-10-7-9-24(19-25)20-33-15-17-35-18-16-33/h7-12,19,22-23H,5-6,13-18,20-21H2,1-4H3,(H2,31,32,34) ONHJZSIHUMTNFF-UHFFFAOYSA-N 50041733 1-(2,6-Diisopropyl-phenyl)-3-[1-(3-morpholin-4-ylmethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL295671 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 11 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041733 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041733&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10254469 103973423 CHEMBL295671 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035611 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(O)cc1 InChI=1S/C25H34N2O2/c1-17(2)21-8-7-9-22(18(3)4)23(21)27-24(29)26-16-25(14-5-6-15-25)19-10-12-20(28)13-11-19/h7-13,17-18,28H,5-6,14-16H2,1-4H3,(H2,26,27,29) SITWDOURDRGUCS-UHFFFAOYSA-N 50041753 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-hydroxy-phenyl)-cyclopentylmethyl]-urea::CHEMBL297198 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 42 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041753 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041753&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10023571 103973443 CHEMBL297198 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035612 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CN2CCN(C)CC2)c1 InChI=1S/C31H46N4O/c1-23(2)27-12-9-13-28(24(3)4)29(27)33-30(36)32-22-31(14-6-7-15-31)26-11-8-10-25(20-26)21-35-18-16-34(5)17-19-35/h8-13,20,23-24H,6-7,14-19,21-22H2,1-5H3,(H2,32,33,36) MAZSHSLMMRLBNW-UHFFFAOYSA-N 50041749 1-(2,6-Diisopropyl-phenyl)-3-{1-[3-(4-methyl-piperazin-1-ylmethyl)-phenyl]-cyclopentylmethyl}-urea::CHEMBL42890 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 16 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041749 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041749&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10435692 103973439 CHEMBL42890 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035613 CC(C)c1cccc(c1NC(=O)NCC2(CCCC2)c3ccc(cc3)N(C)C)C(C)C InChI=1S/C27H39N3O/c1-19(2)23-10-9-11-24(20(3)4)25(23)29-26(31)28-18-27(16-7-8-17-27)21-12-14-22(15-13-21)30(5)6/h9-15,19-20H,7-8,16-18H2,1-6H3,(H2,28,29,31) PKKNCEXEVUFFFI-UHFFFAOYSA-N 50041735 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-dimethylamino-phenyl)-cyclopentylmethyl]-urea; hydrochloride::CHEMBL46423::CHEMBL542103 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 37 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041735 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041735&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search ROV 6VUM,7N6R 131679 103973425 CHEMBL542103CHEMBL46423 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035614 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(cc1)[N+]([O-])=O InChI=1S/C25H33N3O3/c1-17(2)21-8-7-9-22(18(3)4)23(21)27-24(29)26-16-25(14-5-6-15-25)19-10-12-20(13-11-19)28(30)31/h7-13,17-18H,5-6,14-16H2,1-4H3,(H2,26,27,29) RPVUZRVFPOWFML-UHFFFAOYSA-N 50041768 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-nitro-phenyl)-cyclopentylmethyl]-urea::CHEMBL42596 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 131 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041768 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041768&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 11743040 103973458 CHEMBL42596 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035615 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccccc1N InChI=1S/C25H35N3O/c1-17(2)19-10-9-11-20(18(3)4)23(19)28-24(29)27-16-25(14-7-8-15-25)21-12-5-6-13-22(21)26/h5-6,9-13,17-18H,7-8,14-16,26H2,1-4H3,(H2,27,28,29) IFESUOVPWVYTDW-UHFFFAOYSA-N 50041751 1-[1-(2-Amino-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL42544 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 140 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041751 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041751&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10318441 103973441 CHEMBL42544 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035616 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccccc1C InChI=1S/C26H36N2O/c1-18(2)21-12-10-13-22(19(3)4)24(21)28-25(29)27-17-26(15-8-9-16-26)23-14-7-6-11-20(23)5/h6-7,10-14,18-19H,8-9,15-17H2,1-5H3,(H2,27,28,29) WFXHONYRWPMNEO-UHFFFAOYSA-N 50041771 1-(2,6-Diisopropyl-phenyl)-3-(1-o-tolyl-cyclopentylmethyl)-urea::CHEMBL43856 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 17 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041771 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041771&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10091938 103973461 CHEMBL43856 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035617 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CBr)c1 InChI=1S/C26H35BrN2O/c1-18(2)22-11-8-12-23(19(3)4)24(22)29-25(30)28-17-26(13-5-6-14-26)21-10-7-9-20(15-21)16-27/h7-12,15,18-19H,5-6,13-14,16-17H2,1-4H3,(H2,28,29,30) SEEUFCOYSBFVRU-UHFFFAOYSA-N 50041740 1-[1-(3-Bromomethyl-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL290655 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 44 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041740 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041740&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10412477 103973430 CHEMBL290655 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035618 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cc(C)ccc1C InChI=1S/C27H38N2O/c1-18(2)22-10-9-11-23(19(3)4)25(22)29-26(30)28-17-27(14-7-8-15-27)24-16-20(5)12-13-21(24)6/h9-13,16,18-19H,7-8,14-15,17H2,1-6H3,(H2,28,29,30) OUUPLVBWAWIJKI-UHFFFAOYSA-N 50041746 1-(2,6-Diisopropyl-phenyl)-3-[1-(2,5-dimethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL289483 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 39 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041746 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041746&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10454038 103973436 CHEMBL289483 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035619 COc1cccc(c1)C1(CNC(=O)Nc2c(cccc2C(C)C)C(C)C)CCCC1 InChI=1S/C26H36N2O2/c1-18(2)22-12-9-13-23(19(3)4)24(22)28-25(29)27-17-26(14-6-7-15-26)20-10-8-11-21(16-20)30-5/h8-13,16,18-19H,6-7,14-15,17H2,1-5H3,(H2,27,28,29) VVFZEGFJQUJNRQ-UHFFFAOYSA-N 50041764 1-(2,6-Diisopropyl-phenyl)-3-[1-(3-methoxy-phenyl)-cyclopentylmethyl]-urea::CHEMBL44906 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 13 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041764 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041764&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10024444 103973454 CHEMBL44906 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035620 COc1ccccc1C1(CNC(=O)Nc2c(cccc2C(C)C)C(C)C)CCCC1 InChI=1S/C26H36N2O2/c1-18(2)20-11-10-12-21(19(3)4)24(20)28-25(29)27-17-26(15-8-9-16-26)22-13-6-7-14-23(22)30-5/h6-7,10-14,18-19H,8-9,15-17H2,1-5H3,(H2,27,28,29) YDKORNUIFCZMAR-UHFFFAOYSA-N 50041752 1-(2,6-Diisopropyl-phenyl)-3-[1-(2-methoxy-phenyl)-cyclopentylmethyl]-urea::CHEMBL297221 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 23 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041752 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041752&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10024443 103973442 CHEMBL297221 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035621 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(F)cc1 InChI=1S/C25H33FN2O/c1-17(2)21-8-7-9-22(18(3)4)23(21)28-24(29)27-16-25(14-5-6-15-25)19-10-12-20(26)13-11-19/h7-13,17-18H,5-6,14-16H2,1-4H3,(H2,27,28,29) FMZVCBFPBHDUQZ-UHFFFAOYSA-N 50041737 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-fluoro-phenyl)-cyclopentylmethyl]-urea::CHEMBL43431 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 23 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041737 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041737&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10453372 103973427 CHEMBL43431 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035622 COc1ccc(cc1)C1(CNC(=O)Nc2c(cccc2C(C)C)C(C)C)CCCC1 InChI=1S/C26H36N2O2/c1-18(2)22-9-8-10-23(19(3)4)24(22)28-25(29)27-17-26(15-6-7-16-26)20-11-13-21(30-5)14-12-20/h8-14,18-19H,6-7,15-17H2,1-5H3,(H2,27,28,29) HBJTXYVIBJSOCA-UHFFFAOYSA-N 50041723 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-methoxy-phenyl)-cyclopentylmethyl]-urea::CHEMBL44264 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 31 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041723 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041723&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10341424 103973413 CHEMBL44264 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035623 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(OCc2ccccc2)c1 InChI=1S/C32H40N2O2/c1-23(2)28-16-11-17-29(24(3)4)30(28)34-31(35)33-22-32(18-8-9-19-32)26-14-10-15-27(20-26)36-21-25-12-6-5-7-13-25/h5-7,10-17,20,23-24H,8-9,18-19,21-22H2,1-4H3,(H2,33,34,35) KETRASYQQVHMLH-UHFFFAOYSA-N 50041748 1-[1-(3-Benzyloxy-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL45098 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 30 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041748 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041748&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 11755096 103973438 CHEMBL45098 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035624 COC(=O)c1cccc(c1)C1(CNC(=O)Nc2c(cccc2C(C)C)C(C)C)CCCC1 InChI=1S/C27H36N2O3/c1-18(2)22-12-9-13-23(19(3)4)24(22)29-26(31)28-17-27(14-6-7-15-27)21-11-8-10-20(16-21)25(30)32-5/h8-13,16,18-19H,6-7,14-15,17H2,1-5H3,(H2,28,29,31) QUUOEEFGCRTLIU-UHFFFAOYSA-N 50041757 3-{1-[3-(2,6-Diisopropyl-phenyl)-ureidomethyl]-cyclopentyl}-benzoic acid methyl ester::CHEMBL46531 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 34 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041757 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041757&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10320847 103973447 CHEMBL46531 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035625 CC(C)c1ccc(cc1)C1(CNC(=O)Nc2c(cccc2C(C)C)C(C)C)CCCC1 InChI=1S/C28H40N2O/c1-19(2)22-12-14-23(15-13-22)28(16-7-8-17-28)18-29-27(31)30-26-24(20(3)4)10-9-11-25(26)21(5)6/h9-15,19-21H,7-8,16-18H2,1-6H3,(H2,29,30,31) KBEYXMLRWVVRFI-UHFFFAOYSA-N 50041726 1-(2,6-Diisopropyl-phenyl)-3-[1-(4-isopropyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL44266 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 48 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041726 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041726&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 11742896 103973416 CHEMBL44266 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035626 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CN)c1 InChI=1S/C26H37N3O/c1-18(2)22-11-8-12-23(19(3)4)24(22)29-25(30)28-17-26(13-5-6-14-26)21-10-7-9-20(15-21)16-27/h7-12,15,18-19H,5-6,13-14,16-17,27H2,1-4H3,(H2,28,29,30) BFNAWEGHQOHLKN-UHFFFAOYSA-N 50041754 1-[1-(3-Aminomethyl-phenyl)-cyclopentylmethyl]-3-(2,6-diisopropyl-phenyl)-urea::CHEMBL297311 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 440 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041754 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041754&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10409140 103973444 CHEMBL297311 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035627 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(c1)C(F)(F)F InChI=1S/C26H33F3N2O/c1-17(2)21-11-8-12-22(18(3)4)23(21)31-24(32)30-16-25(13-5-6-14-25)19-9-7-10-20(15-19)26(27,28)29/h7-12,15,17-18H,5-6,13-14,16H2,1-4H3,(H2,30,31,32) FHRUITWXUUUWPZ-UHFFFAOYSA-N 50041741 1-(2,6-Diisopropyl-phenyl)-3-[1-(3-trifluoromethyl-phenyl)-cyclopentylmethyl]-urea::CHEMBL46505 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 27 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041741 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041741&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10049240 103973431 CHEMBL46505 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035628 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(c1)N(C)C InChI=1S/C27H39N3O/c1-19(2)23-13-10-14-24(20(3)4)25(23)29-26(31)28-18-27(15-7-8-16-27)21-11-9-12-22(17-21)30(5)6/h9-14,17,19-20H,7-8,15-16,18H2,1-6H3,(H2,28,29,31) SRDBSCZOVOCRQA-UHFFFAOYSA-N 50041731 1-(2,6-Diisopropyl-phenyl)-3-[1-(3-dimethylamino-phenyl)-cyclopentylmethyl]-urea::CHEMBL439926 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 33 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041731 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041731&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 9979602 103973421 CHEMBL439926 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035629 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(CN(C)C)c1 InChI=1S/C28H41N3O/c1-20(2)24-13-10-14-25(21(3)4)26(24)30-27(32)29-19-28(15-7-8-16-28)23-12-9-11-22(17-23)18-31(5)6/h9-14,17,20-21H,7-8,15-16,18-19H2,1-6H3,(H2,29,30,32) CAFXWIACTUBFTP-UHFFFAOYSA-N 50041724 1-(2,6-Diisopropyl-phenyl)-3-[1-(3-dimethylaminomethyl-phenyl)-cyclopentylmethyl]-urea; hydrochloride::CHEMBL42236::CHEMBL545661 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 63 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041724 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041724&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10455652 103973414 CHEMBL545661CHEMBL42236 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035630 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1ccc(CC(C)(C)C)cc1 InChI=1S/C30H44N2O/c1-21(2)25-11-10-12-26(22(3)4)27(25)32-28(33)31-20-30(17-8-9-18-30)24-15-13-23(14-16-24)19-29(5,6)7/h10-16,21-22H,8-9,17-20H2,1-7H3,(H2,31,32,33) ZOELJTWZCYDRGJ-UHFFFAOYSA-N 50041766 1-(2,6-Diisopropyl-phenyl)-3-{1-[4-(2,2-dimethyl-propyl)-phenyl]-cyclopentylmethyl}-urea::CHEMBL42723 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 159 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041766 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041766&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10049350 103973456 CHEMBL42723 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035631 COC(=O)c1ccc(cc1)C1(CNC(=O)Nc2c(cccc2C(C)C)C(C)C)CCCC1 InChI=1S/C27H36N2O3/c1-18(2)22-9-8-10-23(19(3)4)24(22)29-26(31)28-17-27(15-6-7-16-27)21-13-11-20(12-14-21)25(30)32-5/h8-14,18-19H,6-7,15-17H2,1-5H3,(H2,28,29,31) FSTZAGKWMBXIEB-UHFFFAOYSA-N 50041750 4-{1-[3-(2,6-Diisopropyl-phenyl)-ureidomethyl]-cyclopentyl}-benzoic acid methyl ester::CHEMBL297747 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 360 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041750 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041750&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 11743755 103973440 CHEMBL297747 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214 50035632 CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(CCCC1)c1cccc(C)c1 InChI=1S/C26H36N2O/c1-18(2)22-12-9-13-23(19(3)4)24(22)28-25(29)27-17-26(14-6-7-15-26)21-11-8-10-20(5)16-21/h8-13,16,18-19H,6-7,14-15,17H2,1-5H3,(H2,27,28,29) QSBXPJGVWQPMEZ-UHFFFAOYSA-N 50041770 1-(2,6-Diisopropyl-phenyl)-3-(1-m-tolyl-cyclopentylmethyl)-urea::CHEMBL295134 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 15 ChEMBL 10.1021/jm00037a016 10.7270/Q2WQ04DZ 8201599 Trivedi, BK; Purchase, TS; Holmes, A; Augelli-Szafran, CE; Essenburg, AD; Hamelehle, KL; Stanfield, RL; Bousley, RF; Krause, BR 7/7/1994 10/27/2012 Warner-Lambert http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041770 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50000059&target=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041770&enzyme=Acyl-CoA%3Acholesterol+acyltransferase&column=ki&startPg=0&Increment=50&submit=Search 10340506 103973460 CHEMBL295134 1 PLFLKEVGSHFDDFVTNLIEKSASLDNGGCALTTFSILKEMKNNHRAKDLRAPPEQGKIFVARRSLLDELFEVDHIRTIYHMFIALLILFILSTLVVDYIDEGRLVLEFNLLSYAFGKLPTVVWTWWTMFLSTLSIPYFLFQHWANGYSKSSHPLMYSLFHGLLFMVFQLGILGFGPTYIVLAYTLPPASRFIVILEQIRLIMKAHSFVRENVPRVLNSAKEKSSTVPIPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFAQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCIF Sterol O-acyltransferase 1 Q95214_RABIT Q95214