BDBM50070256 (R)-2-((S)-2-Hydroxy-3-mercapto-propyl)-nonanoic acid ((S)-2,2-dimethyl-1-methylcarbamoyl-propyl)-amide::CHEMBL16519
SMILES: CCCCCCC[C@H](C[C@H](O)CS)C(=O)N[C@H](C(=O)NC)C(C)(C)C
InChI Key: InChIKey=PNKICJSNJYXQOE-OWCLPIDISA-N
Data: 3 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Matrix metalloproteinase-9 (Homo sapiens (Human)) | BDBM50070256 ((R)-2-((S)-2-Hydroxy-3-mercapto-propyl)-nonanoic a...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 0.140 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth-Ayerst Research Curated by ChEMBL | Assay Description Inhibition of matrix metalloproteinase-9, gelatinase-B | Bioorg Med Chem Lett 8: 1163-8 (1999) BindingDB Entry DOI: 10.7270/Q2348JH9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Interstitial collagenase (Homo sapiens (Human)) | BDBM50070256 ((R)-2-((S)-2-Hydroxy-3-mercapto-propyl)-nonanoic a...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth-Ayerst Research Curated by ChEMBL | Assay Description Inhibition of matrix metalloproteinase-1, Collagenase-1 | Bioorg Med Chem Lett 8: 1163-8 (1999) BindingDB Entry DOI: 10.7270/Q2348JH9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Stromelysin-1 (Homo sapiens (Human)) | BDBM50070256 ((R)-2-((S)-2-Hydroxy-3-mercapto-propyl)-nonanoic a...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth-Ayerst Research Curated by ChEMBL | Assay Description Inhibition of matrix metalloproteinase-3, stromelysin-1 | Bioorg Med Chem Lett 8: 1163-8 (1999) BindingDB Entry DOI: 10.7270/Q2348JH9 | |||||||||||
More data for this Ligand-Target Pair |