BDBM50246792 CHEMBL508335::N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-(methylcarbamoyl)-ethylcarbamoyl]-(5-methylhexanoyl)}-N-4-(4-bromophenyl)-benzenesulfonylhydrazide
SMILES: CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NNS(=O)(=O)c1ccc(cc1)-c1ccc(Br)cc1
InChI Key: InChIKey=ODFXJYBYTABKHA-BTYSJIOQSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
72 kDa type IV collagenase (Homo sapiens (Human)) | BDBM50246792 (CHEMBL508335 | N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 8.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Reims-Champagne-Ardenne Curated by ChEMBL | Assay Description Inhibition of human recombinant pro-MMP2 by spectrofluorimeter | Bioorg Med Chem 16: 8745-59 (2008) Article DOI: 10.1016/j.bmc.2008.07.041 BindingDB Entry DOI: 10.7270/Q2R49QM0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Stromelysin-1 (Homo sapiens (Human)) | BDBM50246792 (CHEMBL508335 | N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 415 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Reims-Champagne-Ardenne Curated by ChEMBL | Assay Description Inhibition of human recombinant MMP3 catalytic domain by spectrofluorimeter | Bioorg Med Chem 16: 8745-59 (2008) Article DOI: 10.1016/j.bmc.2008.07.041 BindingDB Entry DOI: 10.7270/Q2R49QM0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Matrix metalloproteinase-7 (MMP7) (Homo sapiens (Human)) | BDBM50246792 (CHEMBL508335 | N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 523 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Reims-Champagne-Ardenne Curated by ChEMBL | Assay Description Inhibition of human recombinant pro-MMP7 by spectrofluorimeter | Bioorg Med Chem 16: 8745-59 (2008) Article DOI: 10.1016/j.bmc.2008.07.041 BindingDB Entry DOI: 10.7270/Q2R49QM0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Matrix metalloproteinase-14 (MMP14) (Homo sapiens (Human)) | BDBM50246792 (CHEMBL508335 | N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Reims-Champagne-Ardenne Curated by ChEMBL | Assay Description Inhibition of human recombinant MMP14 catalytic domain by spectrofluorimeter | Bioorg Med Chem 16: 8745-59 (2008) Article DOI: 10.1016/j.bmc.2008.07.041 BindingDB Entry DOI: 10.7270/Q2R49QM0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Stromelysin-1 (Homo sapiens (Human)) | BDBM50246792 (CHEMBL508335 | N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-...) | 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 | 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Reims-Champagne-Ardenne Curated by ChEMBL | Assay Description Inhibition of human recombinant MMP3 catalytic domain by spectrofluorimeter | Bioorg Med Chem 16: 8745-59 (2008) Article DOI: 10.1016/j.bmc.2008.07.041 BindingDB Entry DOI: 10.7270/Q2R49QM0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Matrix metalloproteinase-7 (MMP7) (Homo sapiens (Human)) | BDBM50246792 (CHEMBL508335 | N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-...) | 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 | 475 | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Reims-Champagne-Ardenne Curated by ChEMBL | Assay Description Inhibition of human recombinant pro-MMP7 by spectrofluorimeter | Bioorg Med Chem 16: 8745-59 (2008) Article DOI: 10.1016/j.bmc.2008.07.041 BindingDB Entry DOI: 10.7270/Q2R49QM0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Interstitial collagenase (Homo sapiens (Human)) | BDBM50246792 (CHEMBL508335 | N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-...) | 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 |
Université de Reims-Champagne-Ardenne Curated by ChEMBL | Assay Description Inhibition of human recombinant pro-MMP1 by spectrofluorimeter | Bioorg Med Chem 16: 8745-59 (2008) Article DOI: 10.1016/j.bmc.2008.07.041 BindingDB Entry DOI: 10.7270/Q2R49QM0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Matrix metalloproteinase-9 (Homo sapiens (Human)) | BDBM50246792 (CHEMBL508335 | N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-...) | 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 | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Reims-Champagne-Ardenne Curated by ChEMBL | Assay Description Inhibition of human recombinant pro-MMP9 by spectrofluorimeter | Bioorg Med Chem 16: 8745-59 (2008) Article DOI: 10.1016/j.bmc.2008.07.041 BindingDB Entry DOI: 10.7270/Q2R49QM0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
72 kDa type IV collagenase (Homo sapiens (Human)) | BDBM50246792 (CHEMBL508335 | N'-{3-(R)-[2-(S)-(1H-Indol-3-yl)-1-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 9.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Reims-Champagne-Ardenne Curated by ChEMBL | Assay Description Inhibition of human recombinant pro-MMP2 by spectrofluorimeter | Bioorg Med Chem 16: 8745-59 (2008) Article DOI: 10.1016/j.bmc.2008.07.041 BindingDB Entry DOI: 10.7270/Q2R49QM0 | |||||||||||
More data for this Ligand-Target Pair |