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 50045640 CC(C)C(NC(=O)Cn1c(ccc(NC(=O)OCc2ccccc2)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C27H26F3N3O5/c1-17(2)23(24(35)27(28,29)30)32-22(34)15-33-21(19-11-7-4-8-12-19)14-13-20(25(33)36)31-26(37)38-16-18-9-5-3-6-10-18/h3-14,17,23H,15-16H2,1-2H3,(H,31,37)(H,32,34) MQIPGYPHWSTWGE-UHFFFAOYSA-N 50036127 {2-Oxo-6-phenyl-1-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,2-dihydro-pyridin-3-yl}-carbamic acid benzyl ester::CHEMBL11391 Neutrophil elastase Homo sapiens 4.5 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50036127 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50036127&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10369681 103943992 CHEMBL11391 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50045641 CC(C)C(NC(=O)Cn1cccc(NC(=O)OCc2ccccc2)c1=O)C(=O)C(F)(F)F InChI=1S/C21H22F3N3O5/c1-13(2)17(18(29)21(22,23)24)26-16(28)11-27-10-6-9-15(19(27)30)25-20(31)32-12-14-7-4-3-5-8-14/h3-10,13,17H,11-12H2,1-2H3,(H,25,31)(H,26,28) KDWLXRNZUBXOCU-UHFFFAOYSA-N 50037109 {2-Oxo-1-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,2-dihydro-pyridin-3-yl}-carbamic acid benzyl ester::CHEMBL13684 Neutrophil elastase Homo sapiens 280 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50037109 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50037109&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10004044 103944687 CHEMBL13684 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50045642 CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)C(F)(F)F InChI=1S/C24H32F3N3O5/c1-14(2)18(20(31)24(25,26)27)28-21(32)17-11-8-12-30(17)22(33)19(15(3)4)29-23(34)35-13-16-9-6-5-7-10-16/h5-7,9-10,14-15,17-19H,8,11-13H2,1-4H3,(H,28,32)(H,29,34) FVOBWOKIKIDXMP-UHFFFAOYSA-N 50036058 {(S)-2-Methyl-1-[(S)-2-((S)-3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-pyrrolidine-1-carbonyl]-propyl}-carbamic acid benzyl ester::benzyl (S)-1-((S)-2-(((S)-1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl)carbamoyl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-ylcarbamate::CHEMBL354883 Neutrophil elastase Homo sapiens 1.6 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50036058 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50036058&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 44381293 103943923 CHEMBL354883 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083515 CC(C)C(NC(=O)Cn1c(ccc(NC(=O)NCc2ccncc2)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C26H26F3N5O4/c1-16(2)22(23(36)26(27,28)29)33-21(35)15-34-20(18-6-4-3-5-7-18)9-8-19(24(34)37)32-25(38)31-14-17-10-12-30-13-11-17/h3-13,16,22H,14-15H2,1-2H3,(H,33,35)(H2,31,32,38) UTKFBCLYFMQFLR-UHFFFAOYSA-N 50037352 2-[2-Oxo-6-phenyl-3-((S)-3-pyridin-4-ylmethyl-ureido)-2H-pyridin-1-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::2-[2-Oxo-6-phenyl-3-(3-pyridin-4-ylmethyl-ureido)-2H-pyridin-1-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL278222 Neutrophil elastase Homo sapiens 16 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50037352 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50037352&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10052690 103944899 CHEMBL278222 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083516 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(Cc3cccc4ccccc34)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C26H23F3N4O5/c1-14(2)20(22(35)26(27,28)29)30-19(34)13-32-11-10-18-21(24(32)37)31-25(38)33(23(18)36)12-16-8-5-7-15-6-3-4-9-17(15)16/h3-11,14,20H,12-13H2,1-2H3,(H,30,34)(H,31,38) FRFUTBRZEHHJNP-UHFFFAOYSA-N 50051135 2-((R)-3-Naphthalen-1-ylmethyl-2,4,8-trioxo-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL14177 Neutrophil elastase Homo sapiens 26 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051135 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051135&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 9871592 103948133 CHEMBL14177 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083517 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(CC(=O)OCc3ccccc3)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C24H23F3N4O7/c1-13(2)18(20(34)24(25,26)27)28-16(32)10-30-9-8-15-19(22(30)36)29-23(37)31(21(15)35)11-17(33)38-12-14-6-4-3-5-7-14/h3-9,13,18H,10-12H2,1-2H3,(H,28,32)(H,29,37) IMZGLRIYUYCKGL-UHFFFAOYSA-N 50051136 {(R)-2,4,8-Trioxo-7-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,4,7,8-tetrahydro-2H-pyrido[3,4-d]pyrimidin-3-yl}-acetic acid benzyl ester::CHEMBL13740 Neutrophil elastase Homo sapiens 44 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051136 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051136&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10673918 103948134 CHEMBL13740 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083518 CC(C)C(NC(=O)Cn1c(cc2c([nH]c(=O)n(CC(=O)NCc3ccccc3)c2=O)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C30H28F3N5O6/c1-17(2)24(26(41)30(31,32)33)35-23(40)16-37-21(19-11-7-4-8-12-19)13-20-25(28(37)43)36-29(44)38(27(20)42)15-22(39)34-14-18-9-5-3-6-10-18/h3-13,17,24H,14-16H2,1-2H3,(H,34,39)(H,35,40)(H,36,44) IUUYPAYSACVEPI-UHFFFAOYSA-N 50051137 2-[(R)-3-(Benzylcarbamoyl-methyl)-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL275340 Neutrophil elastase Homo sapiens 9.9 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051137 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051137&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10651388 103948135 CHEMBL275340 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083519 COc1ccc(Cn2c(=O)[nH]c3c(ccn(CC(=O)NC(C(C)C)C(=O)C(F)(F)F)c3=O)c2=O)cc1 InChI=1S/C23H23F3N4O6/c1-12(2)17(19(32)23(24,25)26)27-16(31)11-29-9-8-15-18(21(29)34)28-22(35)30(20(15)33)10-13-4-6-14(36-3)7-5-13/h4-9,12,17H,10-11H2,1-3H3,(H,27,31)(H,28,35) PHJQRFRDGYRXSB-UHFFFAOYSA-N 50051138 2-[(R)-3-(4-Methoxy-benzyl)-2,4,8-trioxo-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL416159 Neutrophil elastase Homo sapiens 100 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051138 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051138&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10839361 103948136 CHEMBL416159 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083520 CC(C)C(NC(=O)Cn1c(cc2c([nH]c(=O)[nH]c2=O)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C21H19F3N4O5/c1-10(2)15(17(30)21(22,23)24)25-14(29)9-28-13(11-6-4-3-5-7-11)8-12-16(19(28)32)26-20(33)27-18(12)31/h3-8,10,15H,9H2,1-2H3,(H,25,29)(H2,26,27,31,33) ZNHHLURDTJYWSY-UHFFFAOYSA-N 50051139 N-(3,3,3-Trifluoro-1-isopropyl-2-oxo-propyl)-2-((R)-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-acetamide::CHEMBL13863 Neutrophil elastase Homo sapiens 15 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051139 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051139&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10528103 103948137 CHEMBL13863 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083521 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(CCN3CCOCC3)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C21H26F3N5O6/c1-12(2)15(17(31)21(22,23)24)25-14(30)11-28-4-3-13-16(19(28)33)26-20(34)29(18(13)32)6-5-27-7-9-35-10-8-27/h3-4,12,15H,5-11H2,1-2H3,(H,25,30)(H,26,34) YLLIHMFJAQNQTC-UHFFFAOYSA-N 50051140 2-[(R)-3-(2-Morpholin-4-yl-ethyl)-2,4,8-trioxo-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL269448 Neutrophil elastase Homo sapiens 330 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051140 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051140&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10601497 103948138 CHEMBL269448 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083522 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(CCc3ccccc3)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C23H23F3N4O5/c1-13(2)17(19(32)23(24,25)26)27-16(31)12-29-10-9-15-18(21(29)34)28-22(35)30(20(15)33)11-8-14-6-4-3-5-7-14/h3-7,9-10,13,17H,8,11-12H2,1-2H3,(H,27,31)(H,28,35) DGWKCZNPZPEOIK-UHFFFAOYSA-N 50051141 N-(3,3,3-Trifluoro-1-isopropyl-2-oxo-propyl)-2-((R)-2,4,8-trioxo-3-phenethyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-acetamide::CHEMBL14064 Neutrophil elastase Homo sapiens 42 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051141 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051141&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10696461 103948139 CHEMBL14064 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083523 CC(C)C(NC(=O)Cn1c(ccc(NC(=O)OCc2ccncc2)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C26H25F3N4O5/c1-16(2)22(23(35)26(27,28)29)32-21(34)14-33-20(18-6-4-3-5-7-18)9-8-19(24(33)36)31-25(37)38-15-17-10-12-30-13-11-17/h3-13,16,22H,14-15H2,1-2H3,(H,31,37)(H,32,34) SVIANZQCDOJOQO-UHFFFAOYSA-N 50037375 {2-Oxo-6-phenyl-1-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,2-dihydro-pyridin-3-yl}-carbamic acid pyridin-4-ylmethyl ester::CHEMBL275043 Neutrophil elastase Homo sapiens 8 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50037375 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50037375&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10256440 103944922 CHEMBL275043 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083525 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(CC(C)=O)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C18H19F3N4O6/c1-8(2)12(14(28)18(19,20)21)22-11(27)7-24-5-4-10-13(16(24)30)23-17(31)25(15(10)29)6-9(3)26/h4-5,8,12H,6-7H2,1-3H3,(H,22,27)(H,23,31) QCYCQKKFHIKCGD-UHFFFAOYSA-N 50051142 N-(3,3,3-Trifluoro-1-isopropyl-2-oxo-propyl)-2-[(R)-2,4,8-trioxo-3-(2-oxo-propyl)-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-acetamide::CHEMBL13804 Neutrophil elastase Homo sapiens 310 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051142 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051142&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10694581 103948140 CHEMBL13804 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083526 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(CCc3cccc4ccccc34)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C27H25F3N4O5/c1-15(2)21(23(36)27(28,29)30)31-20(35)14-33-12-11-19-22(25(33)38)32-26(39)34(24(19)37)13-10-17-8-5-7-16-6-3-4-9-18(16)17/h3-9,11-12,15,21H,10,13-14H2,1-2H3,(H,31,35)(H,32,39) WFLDOEIMRXIWPT-UHFFFAOYSA-N 50051144 2-[(R)-3-(2-Naphthalen-1-yl-ethyl)-2,4,8-trioxo-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL273486 Neutrophil elastase Homo sapiens 21 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051144 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051144&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10745054 103948142 CHEMBL273486 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083527 CC(C)C(NC(=O)Cn1c(cc2c([nH]c(=O)n(CCN3CCOCC3)c2=O)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C27H30F3N5O6/c1-16(2)21(23(37)27(28,29)30)31-20(36)15-35-19(17-6-4-3-5-7-17)14-18-22(25(35)39)32-26(40)34(24(18)38)9-8-33-10-12-41-13-11-33/h3-7,14,16,21H,8-13,15H2,1-2H3,(H,31,36)(H,32,40) UBYXQHGKGLHIOW-UHFFFAOYSA-N 50051143 2-[(R)-3-(2-Morpholin-4-yl-ethyl)-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL14293 Neutrophil elastase Homo sapiens 8.4 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051143 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051143&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10793294 103948141 CHEMBL14293 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083528 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(C)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C16H17F3N4O5/c1-7(2)10(12(25)16(17,18)19)20-9(24)6-23-5-4-8-11(14(23)27)21-15(28)22(3)13(8)26/h4-5,7,10H,6H2,1-3H3,(H,20,24)(H,21,28) DLZWZXWNXFDECB-UHFFFAOYSA-N 50051145 2-((R)-3-Methyl-2,4,8-trioxo-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL267800 Neutrophil elastase Homo sapiens 620 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051145 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051145&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 11795366 103948143 CHEMBL267800 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083529 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(-c3ccccc3)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C21H19F3N4O5/c1-11(2)15(17(30)21(22,23)24)25-14(29)10-27-9-8-13-16(19(27)32)26-20(33)28(18(13)31)12-6-4-3-5-7-12/h3-9,11,15H,10H2,1-2H3,(H,25,29)(H,26,33) DQIDMCUBRKTNER-UHFFFAOYSA-N 50051146 N-(3,3,3-Trifluoro-1-isopropyl-2-oxo-propyl)-2-((R)-2,4,8-trioxo-3-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-acetamide::CHEMBL276182 Neutrophil elastase Homo sapiens 830 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051146 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051146&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 11798332 103948144 CHEMBL276182 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083530 CC(C)C(NC(=O)Cn1c(ccc(NC(=O)OCc2ccccc2)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C27H26F3N3O5/c1-17(2)23(24(35)27(28,29)30)32-22(34)15-33-21(19-11-7-4-8-12-19)14-13-20(25(33)36)31-26(37)38-16-18-9-5-3-6-10-18/h3-14,17,23H,15-16H2,1-2H3,(H,31,37)(H,32,34) MQIPGYPHWSTWGE-UHFFFAOYSA-N 50036127 {2-Oxo-6-phenyl-1-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,2-dihydro-pyridin-3-yl}-carbamic acid benzyl ester::CHEMBL11391 Neutrophil elastase Homo sapiens 4.5 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50036127 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50036127&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10369681 103943992 CHEMBL11391 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083531 CCOCCn1c(=O)[nH]c2c(cc(-c3ccccc3)n(CC(=O)NC(C(C)C)C(=O)C(F)(F)F)c2=O)c1=O InChI=1S/C25H27F3N4O6/c1-4-38-11-10-31-22(35)16-12-17(15-8-6-5-7-9-15)32(23(36)20(16)30-24(31)37)13-18(33)29-19(14(2)3)21(34)25(26,27)28/h5-9,12,14,19H,4,10-11,13H2,1-3H3,(H,29,33)(H,30,37) LTKADXBHDBCMBY-UHFFFAOYSA-N 50051147 2-[(R)-3-(2-Ethoxy-ethyl)-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL14165 Neutrophil elastase Homo sapiens 7.5 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051147 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051147&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10816188 103948145 CHEMBL14165 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083532 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(CC(=O)c3ccccc3)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C23H21F3N4O6/c1-12(2)17(19(33)23(24,25)26)27-16(32)11-29-9-8-14-18(21(29)35)28-22(36)30(20(14)34)10-15(31)13-6-4-3-5-7-13/h3-9,12,17H,10-11H2,1-2H3,(H,27,32)(H,28,36) JEIJGIKFLZOMNZ-UHFFFAOYSA-N 50051148 N-(3,3,3-Trifluoro-1-isopropyl-2-oxo-propyl)-2-[(R)-2,4,8-trioxo-3-(2-oxo-2-phenyl-ethyl)-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-acetamide::CHEMBL14222 Neutrophil elastase Homo sapiens 74 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051148 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051148&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10673162 103948146 CHEMBL14222 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083533 CC(C)C(NC(=O)Cn1c(cc2c([nH]c(=O)n(CC(N)=O)c2=O)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C23H22F3N5O6/c1-11(2)17(19(34)23(24,25)26)28-16(33)10-30-14(12-6-4-3-5-7-12)8-13-18(21(30)36)29-22(37)31(20(13)35)9-15(27)32/h3-8,11,17H,9-10H2,1-2H3,(H2,27,32)(H,28,33)(H,29,37) ASHGFPOKNTWDDL-UHFFFAOYSA-N 50051150 2-{(R)-2,4,8-Trioxo-6-phenyl-7-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,4,7,8-tetrahydro-2H-pyrido[3,4-d]pyrimidin-3-yl}-acetamide::CHEMBL13954 Neutrophil elastase Homo sapiens 15 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051150 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051150&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10792102 103948148 CHEMBL13954 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083535 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(CC(=O)OC(C)(C)C)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C21H25F3N4O7/c1-10(2)14(16(31)21(22,23)24)25-12(29)8-27-7-6-11-15(18(27)33)26-19(34)28(17(11)32)9-13(30)35-20(3,4)5/h6-7,10,14H,8-9H2,1-5H3,(H,25,29)(H,26,34) SIITZOXNLYNJJD-UHFFFAOYSA-N 50051154 {(R)-2,4,8-Trioxo-7-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,4,7,8-tetrahydro-2H-pyrido[3,4-d]pyrimidin-3-yl}-acetic acid tert-butyl ester::CHEMBL14176 Neutrophil elastase Homo sapiens 290 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051154 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051154&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 11799612 103948152 CHEMBL14176 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083536 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(Cc3ccccc3)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C22H21F3N4O5/c1-12(2)16(18(31)22(23,24)25)26-15(30)11-28-9-8-14-17(20(28)33)27-21(34)29(19(14)32)10-13-6-4-3-5-7-13/h3-9,12,16H,10-11H2,1-2H3,(H,26,30)(H,27,34) OXIVZQIMMUHSBZ-UHFFFAOYSA-N 50051149 2-((R)-3-Benzyl-2,4,8-trioxo-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL13937 Neutrophil elastase Homo sapiens 160 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051149 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051149&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10648323 103948147 CHEMBL13937 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083537 COC(=O)Cn1c(=O)[nH]c2c(ccn(CC(=O)NC(C(C)C)C(=O)C(F)(F)F)c2=O)c1=O InChI=1S/C18H19F3N4O7/c1-8(2)12(14(28)18(19,20)21)22-10(26)6-24-5-4-9-13(16(24)30)23-17(31)25(15(9)29)7-11(27)32-3/h4-5,8,12H,6-7H2,1-3H3,(H,22,26)(H,23,31) ULZFZBUSHMTYQC-UHFFFAOYSA-N 50051153 {(R)-2,4,8-Trioxo-7-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,4,7,8-tetrahydro-2H-pyrido[3,4-d]pyrimidin-3-yl}-acetic acid methyl ester::CHEMBL14128 Neutrophil elastase Homo sapiens 490 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051153 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051153&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10837647 103948151 CHEMBL14128 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083538 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(CC(O)=O)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C17H17F3N4O7/c1-7(2)11(13(28)17(18,19)20)21-9(25)5-23-4-3-8-12(15(23)30)22-16(31)24(14(8)29)6-10(26)27/h3-4,7,11H,5-6H2,1-2H3,(H,21,25)(H,22,31)(H,26,27) XOFCFVNEUVKTEB-UHFFFAOYSA-N 50051151 {(R)-2,4,8-Trioxo-7-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,4,7,8-tetrahydro-2H-pyrido[3,4-d]pyrimidin-3-yl}-acetic acid::CHEMBL273612 Neutrophil elastase Homo sapiens 690 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051151 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051151&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10718228 103948149 CHEMBL273612 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083539 CNC(=O)Cn1c(=O)[nH]c2c(cc(-c3ccccc3)n(CC(=O)NC(C(C)C)C(=O)C(F)(F)F)c2=O)c1=O InChI=1S/C24H24F3N5O6/c1-12(2)18(20(35)24(25,26)27)29-17(34)11-31-15(13-7-5-4-6-8-13)9-14-19(22(31)37)30-23(38)32(21(14)36)10-16(33)28-3/h4-9,12,18H,10-11H2,1-3H3,(H,28,33)(H,29,34)(H,30,38) LLDJIMYZESJKOB-UHFFFAOYSA-N 50051152 2-((R)-3-Methylcarbamoylmethyl-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL268005 Neutrophil elastase Homo sapiens 22 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051152 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051152&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10744893 103948150 CHEMBL268005 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083540 CC(C)C(NC(=O)Cn1cccc(NC(=O)OCc2ccccc2)c1=O)C(=O)C(F)(F)F InChI=1S/C21H22F3N3O5/c1-13(2)17(18(29)21(22,23)24)26-16(28)11-27-10-6-9-15(19(27)30)25-20(31)32-12-14-7-4-3-5-8-14/h3-10,13,17H,11-12H2,1-2H3,(H,25,31)(H,26,28) KDWLXRNZUBXOCU-UHFFFAOYSA-N 50037109 {2-Oxo-1-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,2-dihydro-pyridin-3-yl}-carbamic acid benzyl ester::CHEMBL13684 Neutrophil elastase Homo sapiens 280 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50037109 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50037109&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10004044 103944687 CHEMBL13684 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083541 CC(C)C(NC(=O)Cn1c(cc2c([nH]c(=O)n(C)c2=O)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C22H21F3N4O5/c1-11(2)16(18(31)22(23,24)25)26-15(30)10-29-14(12-7-5-4-6-8-12)9-13-17(20(29)33)27-21(34)28(3)19(13)32/h4-9,11,16H,10H2,1-3H3,(H,26,30)(H,27,34) XXNQRMGSCMZMGD-UHFFFAOYSA-N 50051156 2-((R)-3-Methyl-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL14115 Neutrophil elastase Homo sapiens 10 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051156 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051156&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10028039 103948154 CHEMBL14115 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083542 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n(c2=O)C(C)(C)Cc2ccccc2)c1=O)C(=O)C(F)(F)F InChI=1S/C25H27F3N4O5/c1-14(2)18(20(34)25(26,27)28)29-17(33)13-31-11-10-16-19(22(31)36)30-23(37)32(21(16)35)24(3,4)12-15-8-6-5-7-9-15/h5-11,14,18H,12-13H2,1-4H3,(H,29,33)(H,30,37) CKRADAFDKRPCDE-UHFFFAOYSA-N 50051155 2-[(R)-3-(1,1-Dimethyl-2-phenyl-ethyl)-2,4,8-trioxo-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL14631 Neutrophil elastase Homo sapiens 16 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051155 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051155&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10744523 103948153 CHEMBL14631 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083543 CC(C)C(NC(=O)Cn1c(cc2c([nH]c(=O)n(c2=O)C(C)(C)Cc2ccccc2)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C31H31F3N4O5/c1-18(2)24(26(40)31(32,33)34)35-23(39)17-37-22(20-13-9-6-10-14-20)15-21-25(28(37)42)36-29(43)38(27(21)41)30(3,4)16-19-11-7-5-8-12-19/h5-15,18,24H,16-17H2,1-4H3,(H,35,39)(H,36,43) SHPRUMMCIIQYBZ-UHFFFAOYSA-N 50041291 2-[3-(1,1-Dimethyl-2-phenyl-ethyl)-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::2-[(R)-3-(1,1-Dimethyl-2-phenyl-ethyl)-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL276307 Neutrophil elastase Homo sapiens 0.95 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041291 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041291&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10257948 103973092 CHEMBL276307 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083544 CC(C)C(NC(=O)Cn1c(cc2c([nH]c(=O)n(N(C)C)c2=O)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C23H24F3N5O5/c1-12(2)17(19(33)23(24,25)26)27-16(32)11-30-15(13-8-6-5-7-9-13)10-14-18(21(30)35)28-22(36)31(20(14)34)29(3)4/h5-10,12,17H,11H2,1-4H3,(H,27,32)(H,28,36) LPOONCUPJSIPJZ-UHFFFAOYSA-N 50051159 2-((R)-3-Dimethylamino-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL278912 Neutrophil elastase Homo sapiens 19 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051159 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051159&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10696947 103948157 CHEMBL278912 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083545 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)[nH]c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C15H15F3N4O5/c1-6(2)9(11(24)15(16,17)18)19-8(23)5-22-4-3-7-10(13(22)26)20-14(27)21-12(7)25/h3-4,6,9H,5H2,1-2H3,(H,19,23)(H2,20,21,25,27) QADJONDJPFYFSA-UHFFFAOYSA-N 50051157 N-(3,3,3-Trifluoro-1-isopropyl-2-oxo-propyl)-2-((R)-2,4,8-trioxo-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl)-acetamide::CHEMBL275723 Neutrophil elastase Homo sapiens 910 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051157 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051157&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10738994 103948155 CHEMBL275723 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083547 COC(Cn1c(=O)[nH]c2c(cc(-c3ccccc3)n(CC(=O)NC(C(C)C)C(=O)C(F)(F)F)c2=O)c1=O)OC InChI=1S/C25H27F3N4O7/c1-13(2)19(21(34)25(26,27)28)29-17(33)11-31-16(14-8-6-5-7-9-14)10-15-20(23(31)36)30-24(37)32(22(15)35)12-18(38-3)39-4/h5-10,13,18-19H,11-12H2,1-4H3,(H,29,33)(H,30,37) PVGSMWXENOSYHZ-UHFFFAOYSA-N 50051158 2-[(R)-3-(2,2-Dimethoxy-ethyl)-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL13902 Neutrophil elastase Homo sapiens 12 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051158 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051158&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10697956 103948156 CHEMBL13902 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083548 COc1ccc(Cn2c(=O)[nH]c3c(cc(-c4ccccc4)n(CC(=O)NC(C(C)C)C(=O)C(F)(F)F)c3=O)c2=O)cc1 InChI=1S/C29H27F3N4O6/c1-16(2)23(25(38)29(30,31)32)33-22(37)15-35-21(18-7-5-4-6-8-18)13-20-24(27(35)40)34-28(41)36(26(20)39)14-17-9-11-19(42-3)12-10-17/h4-13,16,23H,14-15H2,1-3H3,(H,33,37)(H,34,41) HXJSJCIHKJGWCS-UHFFFAOYSA-N 50051160 2-[(R)-3-(4-Methoxy-benzyl)-2,4,8-trioxo-6-phenyl-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL14121 Neutrophil elastase Homo sapiens 5.7 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051160 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051160&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10531366 103948158 CHEMBL14121 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083549 CC(C)C(NC(=O)Cn1cccc(N)c1=O)C(=O)C(F)(F)F InChI=1S/C13H16F3N3O3/c1-7(2)10(11(21)13(14,15)16)18-9(20)6-19-5-3-4-8(17)12(19)22/h3-5,7,10H,6,17H2,1-2H3,(H,18,20) RPVAQYWPIDBFHT-UHFFFAOYSA-N 50037112 2-(3-Amino-2-oxo-2H-pyridin-1-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL14223 Neutrophil elastase Homo sapiens 2700 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50037112 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50037112&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10426076 103944690 CHEMBL14223 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083550 CC(C)C(NC(=O)Cn1c(ccc(N)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C19H20F3N3O3/c1-11(2)16(17(27)19(20,21)22)24-15(26)10-25-14(9-8-13(23)18(25)28)12-6-4-3-5-7-12/h3-9,11,16H,10,23H2,1-2H3,(H,24,26) DKUKYMJFBPYFSS-UHFFFAOYSA-N 50037346 2-(3-Amino-2-oxo-6-phenyl-2H-pyridin-1-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL13923 Neutrophil elastase Homo sapiens 62 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50037346 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50037346&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10250073 103944893 CHEMBL13923 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083551 CC(C)C(NC(=O)Cn1c(ccc(NC(=O)CN2CCOCC2)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C25H29F3N4O5/c1-16(2)22(23(35)25(26,27)28)30-21(34)15-32-19(17-6-4-3-5-7-17)9-8-18(24(32)36)29-20(33)14-31-10-12-37-13-11-31/h3-9,16,22H,10-15H2,1-2H3,(H,29,33)(H,30,34) DLHJWVOSADZOLP-UHFFFAOYSA-N 50037357 2-[3-((S)-2-Morpholin-4-yl-acetylamino)-2-oxo-6-phenyl-2H-pyridin-1-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::2-[3-(2-Morpholin-4-yl-acetylamino)-2-oxo-6-phenyl-2H-pyridin-1-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL14516 Neutrophil elastase Homo sapiens 469.0 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50037357 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50037357&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10481845 103944904 CHEMBL14516 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083552 CC(C)C(NC(=O)Cn1ccc2c([nH]c(=O)n([C@H]3C[C@@H]3c3ccccc3)c2=O)c1=O)C(=O)C(F)(F)F InChI=1S/C24H23F3N4O5/c1-12(2)18(20(33)24(25,26)27)28-17(32)11-30-9-8-14-19(22(30)35)29-23(36)31(21(14)34)16-10-15(16)13-6-4-3-5-7-13/h3-9,12,15-16,18H,10-11H2,1-2H3,(H,28,32)(H,29,36) NYAMKHDFBPRZSF-UHFFFAOYSA-N 50051161 N-(3,3,3-Trifluoro-1-isopropyl-2-oxo-propyl)-2-[(R)-2,4,8-trioxo-3-((1S,2R)-2-phenyl-cyclopropyl)-2,3,4,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-7-yl]-acetamide::CHEMBL276181 Neutrophil elastase Homo sapiens 230 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051161 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051161&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10791626 103948159 CHEMBL276181 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5 50083553 CC(C)C(NC(=O)Cn1c(cc2c([nH]c(=O)n(CC(=O)OCc3ccccc3)c2=O)c1=O)-c1ccccc1)C(=O)C(F)(F)F InChI=1S/C30H27F3N4O7/c1-17(2)24(26(40)30(31,32)33)34-22(38)14-36-21(19-11-7-4-8-12-19)13-20-25(28(36)42)35-29(43)37(27(20)41)15-23(39)44-16-18-9-5-3-6-10-18/h3-13,17,24H,14-16H2,1-2H3,(H,34,38)(H,35,43) DOAODSNRUDGXIN-UHFFFAOYSA-N 50051162 {(R)-2,4,8-Trioxo-6-phenyl-7-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,4,7,8-tetrahydro-2H-pyrido[3,4-d]pyrimidin-3-yl}-acetic acid benzyl ester::CHEMBL13753 Neutrophil elastase Homo sapiens 2.8 ChEMBL 10.1021/jm950684z 10.7270/Q25Q4V6Z 8676347 Edwards, PD; Andisik, DW; Strimpler, AM; Gomes, B; Tuthill, PA 8/15/1996 11/10/2009 Zeneca Pharmaceuticals http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051162 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=5023&target=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051162&enzyme=Neutrophil+elastase&column=ki&startPg=0&Increment=50&submit=Search 10077495 103948160 CHEMBL13753 1 MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH 7WHU,7CBK,9SI4,9ATU,9ATK,9ASX,9ASS,8VK5,8QGX,8G26,8G25,8G24,8D7K,8D7I,8D4U,8D4Q,6SMA,6F5M,6E69,5ABW,5A8Z,5A8Y,5A8X,5A0C,5A0B,5A0A,5A09,4WVP,4NZL,3Q77,3Q76,2Z7F,2RG3,1PPG,1PPF,1H1B Neutrophil elastase ELNE_HUMAN P08246 P09649 Q6B0D9 Q6LDP5