BDBM50090364 3-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl)-ethyl]-cyclohexanecarboxylic acid ethyl ester::CHEMBL40746
SMILES: CCOC(=O)C1CCCC(C1)C(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1
InChI Key: InChIKey=MACBSAQGLFHSQT-UHFFFAOYSA-N
Data: 3 KI
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)) | BDBM50090364 (3-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL 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 |
Rhone Poulenc Rorer Curated by ChEMBL | Assay Description In vitro inhibition of human recombinant Matrix metalloproteinase-2. | Bioorg Med Chem Lett 10: 1637-40 (2000) BindingDB Entry DOI: 10.7270/Q20G3JDK | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Stromelysin-1 (Homo sapiens (Human)) | BDBM50090364 (3-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer Curated by ChEMBL | Assay Description In vitro inhibition of human recombinant Matrix metalloproteinase-3. | Bioorg Med Chem Lett 10: 1637-40 (2000) BindingDB Entry DOI: 10.7270/Q20G3JDK | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Interstitial collagenase (Homo sapiens (Human)) | BDBM50090364 (3-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer Curated by ChEMBL | Assay Description In vitro inhibition of human recombinant Matrix metalloproteinase-1. | Bioorg Med Chem Lett 10: 1637-40 (2000) BindingDB Entry DOI: 10.7270/Q20G3JDK | |||||||||||
More data for this Ligand-Target Pair |