Found 4 hits for monomerid = 50128670 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Collagenase 3
(Homo sapiens (Human)) | BDBM50128670
(1-(4-(2-(piperidin-1-yl)ethoxy)benzyl)-N-hydroxy-4...)Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(Cc2ccc(OCCN3CCCCC3)cc2)CC1)C(=O)NO Show InChI InChI=1S/C27H37N3O6S/c1-35-23-9-11-25(12-10-23)37(33,34)27(26(31)28-32)13-17-30(18-14-27)21-22-5-7-24(8-6-22)36-20-19-29-15-3-2-4-16-29/h5-12,32H,2-4,13-21H2,1H3,(H,28,31) | 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 | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description In vitro inhibitory activity against matrix metalloprotease-13. |
J Med Chem 46: 2376-96 (2003)
Article DOI: 10.1021/jm0205550 BindingDB Entry DOI: 10.7270/Q2N0178C |
More data for this Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50128670
(1-(4-(2-(piperidin-1-yl)ethoxy)benzyl)-N-hydroxy-4...)Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(Cc2ccc(OCCN3CCCCC3)cc2)CC1)C(=O)NO Show InChI InChI=1S/C27H37N3O6S/c1-35-23-9-11-25(12-10-23)37(33,34)27(26(31)28-32)13-17-30(18-14-27)21-22-5-7-24(8-6-22)36-20-19-29-15-3-2-4-16-29/h5-12,32H,2-4,13-21H2,1H3,(H,28,31) | 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 | 393 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description In vitro inhibitory activity against matrix metalloprotease-1 |
J Med Chem 46: 2376-96 (2003)
Article DOI: 10.1021/jm0205550 BindingDB Entry DOI: 10.7270/Q2N0178C |
More data for this Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50128670
(1-(4-(2-(piperidin-1-yl)ethoxy)benzyl)-N-hydroxy-4...)Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(Cc2ccc(OCCN3CCCCC3)cc2)CC1)C(=O)NO Show InChI InChI=1S/C27H37N3O6S/c1-35-23-9-11-25(12-10-23)37(33,34)27(26(31)28-32)13-17-30(18-14-27)21-22-5-7-24(8-6-22)36-20-19-29-15-3-2-4-16-29/h5-12,32H,2-4,13-21H2,1H3,(H,28,31) | 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 | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description In vitro inhibitory activity against matrix metalloprotease-9. |
J Med Chem 46: 2376-96 (2003)
Article DOI: 10.1021/jm0205550 BindingDB Entry DOI: 10.7270/Q2N0178C |
More data for this Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50128670
(1-(4-(2-(piperidin-1-yl)ethoxy)benzyl)-N-hydroxy-4...)Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(Cc2ccc(OCCN3CCCCC3)cc2)CC1)C(=O)NO Show InChI InChI=1S/C27H37N3O6S/c1-35-23-9-11-25(12-10-23)37(33,34)27(26(31)28-32)13-17-30(18-14-27)21-22-5-7-24(8-6-22)36-20-19-29-15-3-2-4-16-29/h5-12,32H,2-4,13-21H2,1H3,(H,28,31) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 386 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description In vitro inhibitory activity against tumor necrosis factor alpha converting enzyme (TACE). |
J Med Chem 46: 2376-96 (2003)
Article DOI: 10.1021/jm0205550 BindingDB Entry DOI: 10.7270/Q2N0178C |
More data for this Ligand-Target Pair | |