Found 18 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281012
((R)-7-Oxo-3-phenyl-4-thia-1-aza-bicyclo[3.2.0]hept...)Show SMILES O=C(OCc1ccccc1)C1=C(S[C@@H]2CC(=O)N12)c1ccccc1 |t:11| Show InChI InChI=1S/C19H15NO3S/c21-15-11-16-20(15)17(18(24-16)14-9-5-2-6-10-14)19(22)23-12-13-7-3-1-4-8-13/h1-10,16H,11-12H2/t16-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 4.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its inhibitory effect against Human leukocyte elastase (HLE) |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281011
((R)-3-Benzyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]hept...)Show SMILES O=C(OCc1ccccc1)C1=C(Cc2ccccc2)S[C@@H]2CC(=O)N12 |c:11| Show InChI InChI=1S/C20H17NO3S/c22-17-12-18-21(17)19(16(25-18)11-14-7-3-1-4-8-14)20(23)24-13-15-9-5-2-6-10-15/h1-10,18H,11-13H2/t18-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50403117
(CHEMBL2115522)Show InChI InChI=1S/C14H13NO4S/c1-9-13(15-11(16)7-12(15)20(9)18)14(17)19-8-10-5-3-2-4-6-10/h2-6,12H,7-8H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its inhibitory effect against Human leukocyte elastase (HLE) |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281010
((R)-3-Methyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]hept...)Show SMILES CC1=C(N2[C@@H](CC2=O)S1)C(=O)OCc1ccccc1 |t:1| Show InChI InChI=1S/C14H13NO3S/c1-9-13(15-11(16)7-12(15)19-9)14(17)18-8-10-5-3-2-4-6-10/h2-6,12H,7-8H2,1H3/t12-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 3.10E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its inhibitory effect against Human leukocyte elastase (HLE) |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281018
((R)-6-Ethyl-7-oxo-3-phenyl-4-thia-1-aza-bicyclo[3....)Show SMILES CCC1[C@H]2SC(=C(N2C1=O)C(=O)OCc1ccccc1)c1ccccc1 |c:5| Show InChI InChI=1S/C21H19NO3S/c1-2-16-19(23)22-17(21(24)25-13-14-9-5-3-6-10-14)18(26-20(16)22)15-11-7-4-8-12-15/h3-12,16,20H,2,13H2,1H3/t16?,20-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50403118
(CHEMBL2115521)Show SMILES CCSC1=C(N2[C@@H](S1)[C@@H](C(C)C)C2=O)C(=O)OCc1ccccc1 |t:3| Show InChI InChI=1S/C18H21NO3S2/c1-4-23-18-14(17(21)22-10-12-8-6-5-7-9-12)19-15(20)13(11(2)3)16(19)24-18/h5-9,11,13,16H,4,10H2,1-3H3/t13-,16-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281013
((R)-3-Benzyl-6-isopropyl-7-oxo-4-thia-1-aza-bicycl...)Show SMILES CC(C)C1[C@H]2SC(Cc3ccccc3)=C(N2C1=O)C(=O)OCc1ccccc1 |c:14| Show InChI InChI=1S/C23H23NO3S/c1-15(2)19-21(25)24-20(23(26)27-14-17-11-7-4-8-12-17)18(28-22(19)24)13-16-9-5-3-6-10-16/h3-12,15,19,22H,13-14H2,1-2H3/t19?,22-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281020
((R)-6-Isopropyl-3-(1-methyl-1H-tetrazol-5-ylsulfan...)Show SMILES CC(C)C1[C@H]2SC(CSc3nnnn3C)=C(N2C1=O)C(=O)OCc1ccccc1 |c:15| Show InChI InChI=1S/C19H21N5O3S2/c1-11(2)14-16(25)24-15(18(26)27-9-12-7-5-4-6-8-12)13(29-17(14)24)10-28-19-20-21-22-23(19)3/h4-8,11,14,17H,9-10H2,1-3H3/t14?,17-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281019
((R)-6-Isopropyl-7-oxo-3-phenyl-4-thia-1-aza-bicycl...)Show SMILES CC(C)C1[C@H]2SC(=C(N2C1=O)C(=O)OCc1ccccc1)c1ccccc1 |c:6| Show InChI InChI=1S/C22H21NO3S/c1-14(2)17-20(24)23-18(22(25)26-13-15-9-5-3-6-10-15)19(27-21(17)23)16-11-7-4-8-12-16/h3-12,14,17,21H,13H2,1-2H3/t17?,21-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281015
((R)-3-Ethoxy-6-isopropyl-7-oxo-4-thia-1-aza-bicycl...)Show SMILES CCOC1=C(N2[C@H](S1)C(C(C)C)C2=O)C(=O)OCc1ccccc1 |t:3| Show InChI InChI=1S/C18H21NO4S/c1-4-22-18-14(17(21)23-10-12-8-6-5-7-9-12)19-15(20)13(11(2)3)16(19)24-18/h5-9,11,13,16H,4,10H2,1-3H3/t13?,16-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281016
((R)-3-Ethylsulfanyl-6-(1-hydroxy-ethyl)-7-oxo-4-th...)Show SMILES CCSC1=C(N2[C@H](S1)C(C(C)O)C2=O)C(=O)OCc1ccccc1 |t:3| Show InChI InChI=1S/C17H19NO4S2/c1-3-23-17-13(16(21)22-9-11-7-5-4-6-8-11)18-14(20)12(10(2)19)15(18)24-17/h4-8,10,12,15,19H,3,9H2,1-2H3/t10?,12?,15-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281012
((R)-7-Oxo-3-phenyl-4-thia-1-aza-bicyclo[3.2.0]hept...)Show SMILES O=C(OCc1ccccc1)C1=C(S[C@@H]2CC(=O)N12)c1ccccc1 |t:11| Show InChI InChI=1S/C19H15NO3S/c21-15-11-16-20(15)17(18(24-16)14-9-5-2-6-10-14)19(22)23-12-13-7-3-1-4-8-13/h1-10,16H,11-12H2/t16-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50403119
(CHEMBL2115562)Show SMILES CCSC1=C(N2[C@H](S1)[C@@H](C(C)C)C2=O)C(=O)OCc1ccccc1 |t:3| Show InChI InChI=1S/C18H21NO3S2/c1-4-23-18-14(17(21)22-10-12-8-6-5-7-9-12)19-15(20)13(11(2)3)16(19)24-18/h5-9,11,13,16H,4,10H2,1-3H3/t13-,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50403117
(CHEMBL2115522)Show InChI InChI=1S/C14H13NO4S/c1-9-13(15-11(16)7-12(15)20(9)18)14(17)19-8-10-5-3-2-4-6-10/h2-6,12H,7-8H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its inhibitory effect against Human leukocyte elastase (HLE) |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281010
((R)-3-Methyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]hept...)Show SMILES CC1=C(N2[C@@H](CC2=O)S1)C(=O)OCc1ccccc1 |t:1| Show InChI InChI=1S/C14H13NO3S/c1-9-13(15-11(16)7-12(15)19-9)14(17)18-8-10-5-3-2-4-6-10/h2-6,12H,7-8H2,1H3/t12-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281012
((R)-7-Oxo-3-phenyl-4-thia-1-aza-bicyclo[3.2.0]hept...)Show SMILES O=C(OCc1ccccc1)C1=C(S[C@@H]2CC(=O)N12)c1ccccc1 |t:11| Show InChI InChI=1S/C19H15NO3S/c21-15-11-16-20(15)17(18(24-16)14-9-5-2-6-10-14)19(22)23-12-13-7-3-1-4-8-13/h1-10,16H,11-12H2/t16-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its inhibitory effect against Human leukocyte elastase (HLE) |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281011
((R)-3-Benzyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]hept...)Show SMILES O=C(OCc1ccccc1)C1=C(Cc2ccccc2)S[C@@H]2CC(=O)N12 |c:11| Show InChI InChI=1S/C20H17NO3S/c22-17-12-18-21(17)19(16(25-18)11-14-7-3-1-4-8-14)20(23)24-13-15-9-5-2-6-10-15/h1-10,18H,11-13H2/t18-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
Neutrophil elastase
(Homo sapiens (Human)) | BDBM50281014
((R)-6-Isopropyl-3-methyl-7-oxo-4-thia-1-aza-bicycl...)Show SMILES CC(C)C1[C@H]2SC(C)=C(N2C1=O)C(=O)OCc1ccccc1 |c:7| Show InChI InChI=1S/C17H19NO3S/c1-10(2)13-15(19)18-14(11(3)22-16(13)18)17(20)21-9-12-7-5-4-6-8-12/h4-8,10,13,16H,9H2,1-3H3/t13?,16-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Human leukocyte elastase |
Bioorg Med Chem Lett 3: 2277-2282 (1993)
Article DOI: 10.1016/S0960-894X(01)80939-2
BindingDB Entry DOI: 10.7270/Q2WW7HMK |
More data for this
Ligand-Target Pair | |
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