Found 29 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 |
|---|
Stromelysin-3
(Homo sapiens (Human)) | BDBM50138684
((1-Benzyloxycarbonylamino-2-phenyl-ethyl)-{2-[1-ca...)Show SMILES NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCCc1ccccc1)CP(O)(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C39H43N4O6P/c40-37(44)35(24-32-25-41-34-22-11-10-21-33(32)34)42-38(45)31(20-12-19-28-13-4-1-5-14-28)27-50(47,48)36(23-29-15-6-2-7-16-29)43-39(46)49-26-30-17-8-3-9-18-30/h1-11,13-18,21-22,25,31,35-36,41H,12,19-20,23-24,26-27H2,(H2,40,44)(H,42,45)(H,43,46)(H,47,48) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP11 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50138684
((1-Benzyloxycarbonylamino-2-phenyl-ethyl)-{2-[1-ca...)Show SMILES NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCCc1ccccc1)CP(O)(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C39H43N4O6P/c40-37(44)35(24-32-25-41-34-22-11-10-21-33(32)34)42-38(45)31(20-12-19-28-13-4-1-5-14-28)27-50(47,48)36(23-29-15-6-2-7-16-29)43-39(46)49-26-30-17-8-3-9-18-30/h1-11,13-18,21-22,25,31,35-36,41H,12,19-20,23-24,26-27H2,(H2,40,44)(H,42,45)(H,43,46)(H,47,48) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP9 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50180017
(14-methylcarbamoyl-2,8-dioxo-3-phenethyl-1,4,9-tri...)Show SMILES CNC(=O)C1CCCCNC(=O)CCC(NC(CCc2ccccc2)C(=O)N1)C(O)=O Show InChI InChI=1S/C22H32N4O5/c1-23-20(28)16-9-5-6-14-24-19(27)13-12-18(22(30)31)25-17(21(29)26-16)11-10-15-7-3-2-4-8-15/h2-4,7-8,16-18,25H,5-6,9-14H2,1H3,(H,23,28)(H,24,27)(H,26,29)(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP8 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50138684
((1-Benzyloxycarbonylamino-2-phenyl-ethyl)-{2-[1-ca...)Show SMILES NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCCc1ccccc1)CP(O)(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C39H43N4O6P/c40-37(44)35(24-32-25-41-34-22-11-10-21-33(32)34)42-38(45)31(20-12-19-28-13-4-1-5-14-28)27-50(47,48)36(23-29-15-6-2-7-16-29)43-39(46)49-26-30-17-8-3-9-18-30/h1-11,13-18,21-22,25,31,35-36,41H,12,19-20,23-24,26-27H2,(H2,40,44)(H,42,45)(H,43,46)(H,47,48) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP2 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-14
(Homo sapiens (Human)) | BDBM50138684
((1-Benzyloxycarbonylamino-2-phenyl-ethyl)-{2-[1-ca...)Show SMILES NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCCc1ccccc1)CP(O)(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C39H43N4O6P/c40-37(44)35(24-32-25-41-34-22-11-10-21-33(32)34)42-38(45)31(20-12-19-28-13-4-1-5-14-28)27-50(47,48)36(23-29-15-6-2-7-16-29)43-39(46)49-26-30-17-8-3-9-18-30/h1-11,13-18,21-22,25,31,35-36,41H,12,19-20,23-24,26-27H2,(H2,40,44)(H,42,45)(H,43,46)(H,47,48) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| 105 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP14 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50180017
(14-methylcarbamoyl-2,8-dioxo-3-phenethyl-1,4,9-tri...)Show SMILES CNC(=O)C1CCCCNC(=O)CCC(NC(CCc2ccccc2)C(=O)N1)C(O)=O Show InChI InChI=1S/C22H32N4O5/c1-23-20(28)16-9-5-6-14-24-19(27)13-12-18(22(30)31)25-17(21(29)26-16)11-10-15-7-3-2-4-8-15/h2-4,7-8,16-18,25H,5-6,9-14H2,1H3,(H,23,28)(H,24,27)(H,26,29)(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP1 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50180017
(14-methylcarbamoyl-2,8-dioxo-3-phenethyl-1,4,9-tri...)Show SMILES CNC(=O)C1CCCCNC(=O)CCC(NC(CCc2ccccc2)C(=O)N1)C(O)=O Show InChI InChI=1S/C22H32N4O5/c1-23-20(28)16-9-5-6-14-24-19(27)13-12-18(22(30)31)25-17(21(29)26-16)11-10-15-7-3-2-4-8-15/h2-4,7-8,16-18,25H,5-6,9-14H2,1H3,(H,23,28)(H,24,27)(H,26,29)(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP3 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50180017
(14-methylcarbamoyl-2,8-dioxo-3-phenethyl-1,4,9-tri...)Show SMILES CNC(=O)C1CCCCNC(=O)CCC(NC(CCc2ccccc2)C(=O)N1)C(O)=O Show InChI InChI=1S/C22H32N4O5/c1-23-20(28)16-9-5-6-14-24-19(27)13-12-18(22(30)31)25-17(21(29)26-16)11-10-15-7-3-2-4-8-15/h2-4,7-8,16-18,25H,5-6,9-14H2,1H3,(H,23,28)(H,24,27)(H,26,29)(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP9 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50180017
(14-methylcarbamoyl-2,8-dioxo-3-phenethyl-1,4,9-tri...)Show SMILES CNC(=O)C1CCCCNC(=O)CCC(NC(CCc2ccccc2)C(=O)N1)C(O)=O Show InChI InChI=1S/C22H32N4O5/c1-23-20(28)16-9-5-6-14-24-19(27)13-12-18(22(30)31)25-17(21(29)26-16)11-10-15-7-3-2-4-8-15/h2-4,7-8,16-18,25H,5-6,9-14H2,1H3,(H,23,28)(H,24,27)(H,26,29)(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP2 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50104001
(4-(benzylthio)-N-hydroxy-2-(N-isobutyl-4-methoxyph...)Show SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C(CCSCc1ccccc1)C(=O)NO Show InChI InChI=1S/C22H30N2O5S2/c1-17(2)15-24(31(27,28)20-11-9-19(29-3)10-12-20)21(22(25)23-26)13-14-30-16-18-7-5-4-6-8-18/h4-12,17,21,26H,13-16H2,1-3H3,(H,23,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | <0.100 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP9 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50104001
(4-(benzylthio)-N-hydroxy-2-(N-isobutyl-4-methoxyph...)Show SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C(CCSCc1ccccc1)C(=O)NO Show InChI InChI=1S/C22H30N2O5S2/c1-17(2)15-24(31(27,28)20-11-9-19(29-3)10-12-20)21(22(25)23-26)13-14-30-16-18-7-5-4-6-8-18/h4-12,17,21,26H,13-16H2,1-3H3,(H,23,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP3 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50104001
(4-(benzylthio)-N-hydroxy-2-(N-isobutyl-4-methoxyph...)Show SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C(CCSCc1ccccc1)C(=O)NO Show InChI InChI=1S/C22H30N2O5S2/c1-17(2)15-24(31(27,28)20-11-9-19(29-3)10-12-20)21(22(25)23-26)13-14-30-16-18-7-5-4-6-8-18/h4-12,17,21,26H,13-16H2,1-3H3,(H,23,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP2 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50138684
((1-Benzyloxycarbonylamino-2-phenyl-ethyl)-{2-[1-ca...)Show SMILES NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCCc1ccccc1)CP(O)(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C39H43N4O6P/c40-37(44)35(24-32-25-41-34-22-11-10-21-33(32)34)42-38(45)31(20-12-19-28-13-4-1-5-14-28)27-50(47,48)36(23-29-15-6-2-7-16-29)43-39(46)49-26-30-17-8-3-9-18-30/h1-11,13-18,21-22,25,31,35-36,41H,12,19-20,23-24,26-27H2,(H2,40,44)(H,42,45)(H,43,46)(H,47,48) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP8 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50180016
((S)-2-((4-(4-bromobenzamido)phenylsulfonyl)methyl)...)Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)CS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C25H21BrN2O5S/c26-19-7-5-16(6-8-19)24(29)28-20-9-11-21(12-10-20)34(32,33)15-18(25(30)31)13-17-14-27-23-4-2-1-3-22(17)23/h1-12,14,18,27H,13,15H2,(H,28,29)(H,30,31)/t18-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP2 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50180016
((S)-2-((4-(4-bromobenzamido)phenylsulfonyl)methyl)...)Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)CS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C25H21BrN2O5S/c26-19-7-5-16(6-8-19)24(29)28-20-9-11-21(12-10-20)34(32,33)15-18(25(30)31)13-17-14-27-23-4-2-1-3-22(17)23/h1-12,14,18,27H,13,15H2,(H,28,29)(H,30,31)/t18-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP9 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50180019
(2-[2-(4'-chloro-biphenyl-4-yl)-ethanesulfonyl]-1,2...)Show SMILES OC(=O)C1Cc2ccccc2CN1S(=O)(=O)CCc1ccc(cc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C24H22ClNO4S/c25-22-11-9-19(10-12-22)18-7-5-17(6-8-18)13-14-31(29,30)26-16-21-4-2-1-3-20(21)15-23(26)24(27)28/h1-12,23H,13-16H2,(H,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP8 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50104001
(4-(benzylthio)-N-hydroxy-2-(N-isobutyl-4-methoxyph...)Show SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C(CCSCc1ccccc1)C(=O)NO Show InChI InChI=1S/C22H30N2O5S2/c1-17(2)15-24(31(27,28)20-11-9-19(29-3)10-12-20)21(22(25)23-26)13-14-30-16-18-7-5-4-6-8-18/h4-12,17,21,26H,13-16H2,1-3H3,(H,23,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP13 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50180019
(2-[2-(4'-chloro-biphenyl-4-yl)-ethanesulfonyl]-1,2...)Show SMILES OC(=O)C1Cc2ccccc2CN1S(=O)(=O)CCc1ccc(cc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C24H22ClNO4S/c25-22-11-9-19(10-12-22)18-7-5-17(6-8-18)13-14-31(29,30)26-16-21-4-2-1-3-20(21)15-23(26)24(27)28/h1-12,23H,13-16H2,(H,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP3 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Neutrophil collagenase
(Homo sapiens (Human)) | BDBM50180018
((S)-2,N*1*-Dihydroxy-3-isobutyl-N*4*-((S)-2-oxo-az...)Show SMILES CC(C)CC([C@H](O)C(=O)NO)C(=O)N[C@H]1CCCCCCCCCCNC1=O Show InChI InChI=1S/C20H37N3O5/c1-14(2)13-15(17(24)20(27)23-28)18(25)22-16-11-9-7-5-3-4-6-8-10-12-21-19(16)26/h14-17,24,28H,3-13H2,1-2H3,(H,21,26)(H,22,25)(H,23,27)/t15?,16-,17-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP8 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50180019
(2-[2-(4'-chloro-biphenyl-4-yl)-ethanesulfonyl]-1,2...)Show SMILES OC(=O)C1Cc2ccccc2CN1S(=O)(=O)CCc1ccc(cc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C24H22ClNO4S/c25-22-11-9-19(10-12-22)18-7-5-17(6-8-18)13-14-31(29,30)26-16-21-4-2-1-3-20(21)15-23(26)24(27)28/h1-12,23H,13-16H2,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP13 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50180018
((S)-2,N*1*-Dihydroxy-3-isobutyl-N*4*-((S)-2-oxo-az...)Show SMILES CC(C)CC([C@H](O)C(=O)NO)C(=O)N[C@H]1CCCCCCCCCCNC1=O Show InChI InChI=1S/C20H37N3O5/c1-14(2)13-15(17(24)20(27)23-28)18(25)22-16-11-9-7-5-3-4-6-8-10-12-21-19(16)26/h14-17,24,28H,3-13H2,1-2H3,(H,21,26)(H,22,25)(H,23,27)/t15?,16-,17-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP2 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50180018
((S)-2,N*1*-Dihydroxy-3-isobutyl-N*4*-((S)-2-oxo-az...)Show SMILES CC(C)CC([C@H](O)C(=O)NO)C(=O)N[C@H]1CCCCCCCCCCNC1=O Show InChI InChI=1S/C20H37N3O5/c1-14(2)13-15(17(24)20(27)23-28)18(25)22-16-11-9-7-5-3-4-6-8-10-12-21-19(16)26/h14-17,24,28H,3-13H2,1-2H3,(H,21,26)(H,22,25)(H,23,27)/t15?,16-,17-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP1 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50104001
(4-(benzylthio)-N-hydroxy-2-(N-isobutyl-4-methoxyph...)Show SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C(CCSCc1ccccc1)C(=O)NO Show InChI InChI=1S/C22H30N2O5S2/c1-17(2)15-24(31(27,28)20-11-9-19(29-3)10-12-20)21(22(25)23-26)13-14-30-16-18-7-5-4-6-8-18/h4-12,17,21,26H,13-16H2,1-3H3,(H,23,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 104 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP1 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Matrilysin
(Homo sapiens (Human)) | BDBM50180018
((S)-2,N*1*-Dihydroxy-3-isobutyl-N*4*-((S)-2-oxo-az...)Show SMILES CC(C)CC([C@H](O)C(=O)NO)C(=O)N[C@H]1CCCCCCCCCCNC1=O Show InChI InChI=1S/C20H37N3O5/c1-14(2)13-15(17(24)20(27)23-28)18(25)22-16-11-9-7-5-3-4-6-8-10-12-21-19(16)26/h14-17,24,28H,3-13H2,1-2H3,(H,21,26)(H,22,25)(H,23,27)/t15?,16-,17-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP7 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50180018
((S)-2,N*1*-Dihydroxy-3-isobutyl-N*4*-((S)-2-oxo-az...)Show SMILES CC(C)CC([C@H](O)C(=O)NO)C(=O)N[C@H]1CCCCCCCCCCNC1=O Show InChI InChI=1S/C20H37N3O5/c1-14(2)13-15(17(24)20(27)23-28)18(25)22-16-11-9-7-5-3-4-6-8-10-12-21-19(16)26/h14-17,24,28H,3-13H2,1-2H3,(H,21,26)(H,22,25)(H,23,27)/t15?,16-,17-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP3 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Matrilysin
(Homo sapiens (Human)) | BDBM50180016
((S)-2-((4-(4-bromobenzamido)phenylsulfonyl)methyl)...)Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)CS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C25H21BrN2O5S/c26-19-7-5-16(6-8-19)24(29)28-20-9-11-21(12-10-20)34(32,33)15-18(25(30)31)13-17-14-27-23-4-2-1-3-22(17)23/h1-12,14,18,27H,13,15H2,(H,28,29)(H,30,31)/t18-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP7 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50180016
((S)-2-((4-(4-bromobenzamido)phenylsulfonyl)methyl)...)Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)CS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C25H21BrN2O5S/c26-19-7-5-16(6-8-19)24(29)28-20-9-11-21(12-10-20)34(32,33)15-18(25(30)31)13-17-14-27-23-4-2-1-3-22(17)23/h1-12,14,18,27H,13,15H2,(H,28,29)(H,30,31)/t18-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP1 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50180016
((S)-2-((4-(4-bromobenzamido)phenylsulfonyl)methyl)...)Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)CS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C25H21BrN2O5S/c26-19-7-5-16(6-8-19)24(29)28-20-9-11-21(12-10-20)34(32,33)15-18(25(30)31)13-17-14-27-23-4-2-1-3-22(17)23/h1-12,14,18,27H,13,15H2,(H,28,29)(H,30,31)/t18-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP3 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50180019
(2-[2-(4'-chloro-biphenyl-4-yl)-ethanesulfonyl]-1,2...)Show SMILES OC(=O)C1Cc2ccccc2CN1S(=O)(=O)CCc1ccc(cc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C24H22ClNO4S/c25-22-11-9-19(10-12-22)18-7-5-17(6-8-18)13-14-31(29,30)26-16-21-4-2-1-3-20(21)15-23(26)24(27)28/h1-12,23H,13-16H2,(H,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharma Deutschland GmbH
Curated by ChEMBL
| Assay Description
Binding affinity to MMP1 |
J Med Chem 49: 51-69 (2006)
Article DOI: 10.1021/jm050363f
BindingDB Entry DOI: 10.7270/Q20K285S |
More data for this
Ligand-Target Pair | |
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