Found 340 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 collagenase
(Homo sapiens (Human)) | BDBM50088118
(2-(N-(4-nitrobenzyl)-2,3,4,5,6-pentafluorophenylsu...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F Show InChI InChI=1S/C15H10F5N3O6S/c16-10-11(17)13(19)15(14(20)12(10)18)30(28,29)22(6-9(24)21-25)5-7-1-3-8(4-2-7)23(26)27/h1-4,25H,5-6H2,(H,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088126
(CHEMBL293528 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N...)Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)Nc1ccc(cc1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-2-10-20(11-3-16)38(34,35)26-23(30)24-18-6-12-21(13-7-18)39(36,37)27(15-22(29)25-31)14-17-4-8-19(9-5-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088107
(CHEMBL293357 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C22H20FN5O9S2/c23-16-3-9-19(10-4-16)38(34,35)26-22(30)24-17-5-11-20(12-6-17)39(36,37)27(14-21(29)25-31)13-15-1-7-18(8-2-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088107
(CHEMBL293357 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C22H20FN5O9S2/c23-16-3-9-19(10-4-16)38(34,35)26-22(30)24-17-5-11-20(12-6-17)39(36,37)27(14-21(29)25-31)13-15-1-7-18(8-2-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088118
(2-(N-(4-nitrobenzyl)-2,3,4,5,6-pentafluorophenylsu...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F Show InChI InChI=1S/C15H10F5N3O6S/c16-10-11(17)13(19)15(14(20)12(10)18)30(28,29)22(6-9(24)21-25)5-7-1-3-8(4-2-7)23(26)27/h1-4,25H,5-6H2,(H,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088066
(CHEMBL439931 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccccc2)cc1 Show InChI InChI=1S/C22H21N5O9S2/c28-21(24-30)15-26(14-16-6-10-18(11-7-16)27(31)32)38(35,36)20-12-8-17(9-13-20)23-22(29)25-37(33,34)19-4-2-1-3-5-19/h1-13,30H,14-15H2,(H,24,28)(H2,23,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088109
(CHEMBL55521 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N-...)Show SMILES Cc1ccccc1S(=O)(=O)NC(=O)Nc1ccc(cc1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-4-2-3-5-21(16)38(34,35)26-23(30)24-18-8-12-20(13-9-18)39(36,37)27(15-22(29)25-31)14-17-6-10-19(11-7-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088126
(CHEMBL293528 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N...)Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)Nc1ccc(cc1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-2-10-20(11-3-16)38(34,35)26-23(30)24-18-6-12-21(13-7-18)39(36,37)27(15-22(29)25-31)14-17-4-8-19(9-5-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088065
(CHEMBL54054 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-tri...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C16H14F3N3O6S/c17-16(18,19)12-2-1-3-14(8-12)29(27,28)21(10-15(23)20-24)9-11-4-6-13(7-5-11)22(25)26/h1-8,24H,9-10H2,(H,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088118
(2-(N-(4-nitrobenzyl)-2,3,4,5,6-pentafluorophenylsu...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F Show InChI InChI=1S/C15H10F5N3O6S/c16-10-11(17)13(19)15(14(20)12(10)18)30(28,29)22(6-9(24)21-25)5-7-1-3-8(4-2-7)23(26)27/h1-4,25H,5-6H2,(H,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088066
(CHEMBL439931 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccccc2)cc1 Show InChI InChI=1S/C22H21N5O9S2/c28-21(24-30)15-26(14-16-6-10-18(11-7-16)27(31)32)38(35,36)20-12-8-17(9-13-20)23-22(29)25-37(33,34)19-4-2-1-3-5-19/h1-13,30H,14-15H2,(H,24,28)(H2,23,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088065
(CHEMBL54054 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-tri...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C16H14F3N3O6S/c17-16(18,19)12-2-1-3-14(8-12)29(27,28)21(10-15(23)20-24)9-11-4-6-13(7-5-11)22(25)26/h1-8,24H,9-10H2,(H,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088073
(CHEMBL54483 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C22H20ClN5O9S2/c23-16-3-9-19(10-4-16)38(34,35)26-22(30)24-17-5-11-20(12-6-17)39(36,37)27(14-21(29)25-31)13-15-1-7-18(8-2-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088066
(CHEMBL439931 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccccc2)cc1 Show InChI InChI=1S/C22H21N5O9S2/c28-21(24-30)15-26(14-16-6-10-18(11-7-16)27(31)32)38(35,36)20-12-8-17(9-13-20)23-22(29)25-37(33,34)19-4-2-1-3-5-19/h1-13,30H,14-15H2,(H,24,28)(H2,23,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088125
(2-[(Heptadecafluorooctane-1-sulfonyl)-(4-nitro-ben...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F Show InChI InChI=1S/C17H10F17N3O6S/c18-10(19,12(22,23)14(26,27)16(30,31)32)11(20,21)13(24,25)15(28,29)17(33,34)44(42,43)36(6-9(38)35-39)5-7-1-3-8(4-2-7)37(40)41/h1-4,39H,5-6H2,(H,35,38) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088073
(CHEMBL54483 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C22H20ClN5O9S2/c23-16-3-9-19(10-4-16)38(34,35)26-22(30)24-17-5-11-20(12-6-17)39(36,37)27(14-21(29)25-31)13-15-1-7-18(8-2-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088097
(CHEMBL56498 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccccc2)c1 Show InChI InChI=1S/C22H21N5O9S2/c28-21(24-30)15-26(14-16-9-11-18(12-10-16)27(31)32)38(35,36)20-8-4-5-17(13-20)23-22(29)25-37(33,34)19-6-2-1-3-7-19/h1-13,30H,14-15H2,(H,24,28)(H2,23,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088073
(CHEMBL54483 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C22H20ClN5O9S2/c23-16-3-9-19(10-4-16)38(34,35)26-22(30)24-17-5-11-20(12-6-17)39(36,37)27(14-21(29)25-31)13-15-1-7-18(8-2-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088065
(CHEMBL54054 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-tri...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C16H14F3N3O6S/c17-16(18,19)12-2-1-3-14(8-12)29(27,28)21(10-15(23)20-24)9-11-4-6-13(7-5-11)22(25)26/h1-8,24H,9-10H2,(H,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088097
(CHEMBL56498 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccccc2)c1 Show InChI InChI=1S/C22H21N5O9S2/c28-21(24-30)15-26(14-16-9-11-18(12-10-16)27(31)32)38(35,36)20-8-4-5-17(13-20)23-22(29)25-37(33,34)19-6-2-1-3-7-19/h1-13,30H,14-15H2,(H,24,28)(H2,23,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088126
(CHEMBL293528 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N...)Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)Nc1ccc(cc1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-2-10-20(11-3-16)38(34,35)26-23(30)24-18-6-12-21(13-7-18)39(36,37)27(15-22(29)25-31)14-17-4-8-19(9-5-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088107
(CHEMBL293357 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C22H20FN5O9S2/c23-16-3-9-19(10-4-16)38(34,35)26-22(30)24-17-5-11-20(12-6-17)39(36,37)27(14-21(29)25-31)13-15-1-7-18(8-2-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088097
(CHEMBL56498 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccccc2)c1 Show InChI InChI=1S/C22H21N5O9S2/c28-21(24-30)15-26(14-16-9-11-18(12-10-16)27(31)32)38(35,36)20-8-4-5-17(13-20)23-22(29)25-37(33,34)19-6-2-1-3-7-19/h1-13,30H,14-15H2,(H,24,28)(H2,23,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088083
(CHEMBL55522 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)c1 Show InChI InChI=1S/C22H20ClN5O9S2/c23-16-6-10-19(11-7-16)38(34,35)26-22(30)24-17-2-1-3-20(12-17)39(36,37)27(14-21(29)25-31)13-15-4-8-18(9-5-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088125
(2-[(Heptadecafluorooctane-1-sulfonyl)-(4-nitro-ben...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F Show InChI InChI=1S/C17H10F17N3O6S/c18-10(19,12(22,23)14(26,27)16(30,31)32)11(20,21)13(24,25)15(28,29)17(33,34)44(42,43)36(6-9(38)35-39)5-7-1-3-8(4-2-7)37(40)41/h1-4,39H,5-6H2,(H,35,38) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088125
(2-[(Heptadecafluorooctane-1-sulfonyl)-(4-nitro-ben...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F Show InChI InChI=1S/C17H10F17N3O6S/c18-10(19,12(22,23)14(26,27)16(30,31)32)11(20,21)13(24,25)15(28,29)17(33,34)44(42,43)36(6-9(38)35-39)5-7-1-3-8(4-2-7)37(40)41/h1-4,39H,5-6H2,(H,35,38) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088089
(CHEMBL55984 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccc(F)cc2)c1 Show InChI InChI=1S/C22H20FN5O9S2/c23-16-6-10-19(11-7-16)38(34,35)26-22(30)24-17-2-1-3-20(12-17)39(36,37)27(14-21(29)25-31)13-15-4-8-18(9-5-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088120
(2-[3-Benzoyl-1-(4-nitro-benzyl)-thioureido]-N-hydr...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)C(=S)NC(=O)c1ccccc1 Show InChI InChI=1S/C17H16N4O5S/c22-15(19-24)11-20(10-12-6-8-14(9-7-12)21(25)26)17(27)18-16(23)13-4-2-1-3-5-13/h1-9,24H,10-11H2,(H,19,22)(H,18,23,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088109
(CHEMBL55521 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N-...)Show SMILES Cc1ccccc1S(=O)(=O)NC(=O)Nc1ccc(cc1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-4-2-3-5-21(16)38(34,35)26-23(30)24-18-8-12-20(13-9-18)39(36,37)27(15-22(29)25-31)14-17-6-10-19(11-7-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088128
(2-(N-(4-nitrobenzyl)-4,4,12,12,15,15,18,18,18-nona...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F Show InChI InChI=1S/C13H10F9N3O6S/c14-10(15,12(18,19)20)11(16,17)13(21,22)32(30,31)24(6-9(26)23-27)5-7-1-3-8(4-2-7)25(28)29/h1-4,27H,5-6H2,(H,23,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088083
(CHEMBL55522 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)c1 Show InChI InChI=1S/C22H20ClN5O9S2/c23-16-6-10-19(11-7-16)38(34,35)26-22(30)24-17-2-1-3-20(12-17)39(36,37)27(14-21(29)25-31)13-15-4-8-18(9-5-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088120
(2-[3-Benzoyl-1-(4-nitro-benzyl)-thioureido]-N-hydr...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)C(=S)NC(=O)c1ccccc1 Show InChI InChI=1S/C17H16N4O5S/c22-15(19-24)11-20(10-12-6-8-14(9-7-12)21(25)26)17(27)18-16(23)13-4-2-1-3-5-13/h1-9,24H,10-11H2,(H,19,22)(H,18,23,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088109
(CHEMBL55521 | N-Hydroxy-2-[(4-nitro-benzyl)-(4-(N-...)Show SMILES Cc1ccccc1S(=O)(=O)NC(=O)Nc1ccc(cc1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-4-2-3-5-21(16)38(34,35)26-23(30)24-18-8-12-20(13-9-18)39(36,37)27(15-22(29)25-31)14-17-6-10-19(11-7-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088083
(CHEMBL55522 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)c1 Show InChI InChI=1S/C22H20ClN5O9S2/c23-16-6-10-19(11-7-16)38(34,35)26-22(30)24-17-2-1-3-20(12-17)39(36,37)27(14-21(29)25-31)13-15-4-8-18(9-5-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088089
(CHEMBL55984 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccc(F)cc2)c1 Show InChI InChI=1S/C22H20FN5O9S2/c23-16-6-10-19(11-7-16)38(34,35)26-22(30)24-17-2-1-3-20(12-17)39(36,37)27(14-21(29)25-31)13-15-4-8-18(9-5-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088120
(2-[3-Benzoyl-1-(4-nitro-benzyl)-thioureido]-N-hydr...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)C(=S)NC(=O)c1ccccc1 Show InChI InChI=1S/C17H16N4O5S/c22-15(19-24)11-20(10-12-6-8-14(9-7-12)21(25)26)17(27)18-16(23)13-4-2-1-3-5-13/h1-9,24H,10-11H2,(H,19,22)(H,18,23,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088128
(2-(N-(4-nitrobenzyl)-4,4,12,12,15,15,18,18,18-nona...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F Show InChI InChI=1S/C13H10F9N3O6S/c14-10(15,12(18,19)20)11(16,17)13(21,22)32(30,31)24(6-9(26)23-27)5-7-1-3-8(4-2-7)25(28)29/h1-4,27H,5-6H2,(H,23,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088074
(CHEMBL301085 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N...)Show SMILES Cc1ccccc1S(=O)(=O)NC(=O)Nc1cccc(c1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-5-2-3-8-21(16)38(34,35)26-23(30)24-18-6-4-7-20(13-18)39(36,37)27(15-22(29)25-31)14-17-9-11-19(12-10-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088082
(CHEMBL53847 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)Nc1cccc(c1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-5-11-20(12-6-16)38(34,35)26-23(30)24-18-3-2-4-21(13-18)39(36,37)27(15-22(29)25-31)14-17-7-9-19(10-8-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088067
(4-[Hydroxycarbamoylmethyl-(4-nitro-benzyl)-sulfamo...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(cc1)C(O)=O Show InChI InChI=1S/C16H15N3O8S/c20-15(17-23)10-18(9-11-1-5-13(6-2-11)19(24)25)28(26,27)14-7-3-12(4-8-14)16(21)22/h1-8,23H,9-10H2,(H,17,20)(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50088128
(2-(N-(4-nitrobenzyl)-4,4,12,12,15,15,18,18,18-nona...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F Show InChI InChI=1S/C13H10F9N3O6S/c14-10(15,12(18,19)20)11(16,17)13(21,22)32(30,31)24(6-9(26)23-27)5-7-1-3-8(4-2-7)25(28)29/h1-4,27H,5-6H2,(H,23,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease-8 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088089
(CHEMBL55984 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccc(F)cc2)c1 Show InChI InChI=1S/C22H20FN5O9S2/c23-16-6-10-19(11-7-16)38(34,35)26-22(30)24-17-2-1-3-20(12-17)39(36,37)27(14-21(29)25-31)13-15-4-8-18(9-5-15)28(32)33/h1-12,31H,13-14H2,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088082
(CHEMBL53847 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N-...)Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)Nc1cccc(c1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-5-11-20(12-6-16)38(34,35)26-23(30)24-18-3-2-4-21(13-18)39(36,37)27(15-22(29)25-31)14-17-7-9-19(10-8-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088067
(4-[Hydroxycarbamoylmethyl-(4-nitro-benzyl)-sulfamo...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(cc1)C(O)=O Show InChI InChI=1S/C16H15N3O8S/c20-15(17-23)10-18(9-11-1-5-13(6-2-11)19(24)25)28(26,27)14-7-3-12(4-8-14)16(21)22/h1-8,23H,9-10H2,(H,17,20)(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088114
(3-[Hydroxycarbamoylmethyl-(4-nitro-benzyl)-sulfamo...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(c1)C(O)=O Show InChI InChI=1S/C16H15N3O8S/c20-15(17-23)10-18(9-11-4-6-13(7-5-11)19(24)25)28(26,27)14-3-1-2-12(8-14)16(21)22/h1-8,23H,9-10H2,(H,17,20)(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088067
(4-[Hydroxycarbamoylmethyl-(4-nitro-benzyl)-sulfamo...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccc(cc1)C(O)=O Show InChI InChI=1S/C16H15N3O8S/c20-15(17-23)10-18(9-11-1-5-13(6-2-11)19(24)25)28(26,27)14-7-3-12(4-8-14)16(21)22/h1-8,23H,9-10H2,(H,17,20)(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088074
(CHEMBL301085 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N...)Show SMILES Cc1ccccc1S(=O)(=O)NC(=O)Nc1cccc(c1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-5-2-3-8-21(16)38(34,35)26-23(30)24-18-6-4-7-20(13-18)39(36,37)27(15-22(29)25-31)14-17-9-11-19(12-10-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50088074
(CHEMBL301085 | N-Hydroxy-2-[(4-nitro-benzyl)-(3-(N...)Show SMILES Cc1ccccc1S(=O)(=O)NC(=O)Nc1cccc(c1)S(=O)(=O)N(CC(=O)NO)Cc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C23H23N5O9S2/c1-16-5-2-3-8-21(16)38(34,35)26-23(30)24-18-6-4-7-20(13-18)39(36,37)27(15-22(29)25-31)14-17-9-11-19(12-10-17)28(32)33/h2-13,31H,14-15H2,1H3,(H,25,29)(H2,24,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix metalloprotease-9 |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088114
(3-[Hydroxycarbamoylmethyl-(4-nitro-benzyl)-sulfamo...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1cccc(c1)C(O)=O Show InChI InChI=1S/C16H15N3O8S/c20-15(17-23)10-18(9-11-4-6-13(7-5-11)19(24)25)28(26,27)14-3-1-2-12(8-14)16(21)22/h1-8,23H,9-10H2,(H,17,20)(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50088111
(2-[1-(4-nitro-benzyl)-(sulfonyl-(4-chlorobenzene))...)Show SMILES ONC(=O)CN(Cc1ccc(cc1)[N+]([O-])=O)C(=O)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C16H15ClN4O7S/c17-12-3-7-14(8-4-12)29(27,28)19-16(23)20(10-15(22)18-24)9-11-1-5-13(6-2-11)21(25)26/h1-8,24H,9-10H2,(H,18,22)(H,19,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi
Curated by ChEMBL
| Assay Description
Inhibitory activity against the Matrix Metalloprotease 2 (MMP-2) |
J Med Chem 43: 1858-65 (2000)
BindingDB Entry DOI: 10.7270/Q2ZW1K4G |
More data for this
Ligand-Target Pair | |
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