BDBM50310301 CHEMBL599742::N,N'-(ethane-1,2-diyl)bis(N-ethyl-3,4-dihydroxybenzenesulfonamide)::US9120744, CDE-032
SMILES: CCN(CCN(CC)S(=O)(=O)c1ccc(O)c(O)c1)S(=O)(=O)c1ccc(O)c(O)c1
InChI Key: InChIKey=KULDNHPCSUYZFZ-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Plasminogen activator inhibitor-1 (Homo sapiens (Human)) | BDBM50310301 (CHEMBL599742 | N,N'-(ethane-1,2-diyl)bis(N-ethyl-3...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 1.02E+4 | n/a | n/a | n/a | n/a | 7.8 | 23 |
THE REGENTS OF THE UNIVERSITY OF MICHIGAN; EASTERN MICHIGAN UNIVERSITY US Patent | Assay Description To determine the efficacy of various synthesized PAI-1 inhibitor compounds, a fluorometric plate assay was carried out to measure the half maximal in... | US Patent US9120744 (2015) BindingDB Entry DOI: 10.7270/Q2QF8RN8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Coagulation factor X/antithrombin III (Homo sapiens (Human)) | BDBM50310301 (CHEMBL599742 | N,N'-(ethane-1,2-diyl)bis(N-ethyl-3...) | PDB MMDB NCI pathway 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 | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Eastern Michigan University Curated by ChEMBL | Assay Description Inhibition of antithrombin-3 assessed as residual alpha-thrombin activity | Bioorg Med Chem Lett 20: 966-70 (2010) Article DOI: 10.1016/j.bmcl.2009.12.051 BindingDB Entry DOI: 10.7270/Q24M94P3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Plasminogen activator inhibitor-1 (Homo sapiens (Human)) | BDBM50310301 (CHEMBL599742 | N,N'-(ethane-1,2-diyl)bis(N-ethyl-3...) | 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 | 9.32E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eastern Michigan University Curated by ChEMBL | Assay Description Inhibition of human recombinant PAI1 assessed as rate of AMC release after 30 mins | Bioorg Med Chem Lett 20: 966-70 (2010) Article DOI: 10.1016/j.bmcl.2009.12.051 BindingDB Entry DOI: 10.7270/Q24M94P3 | |||||||||||
More data for this Ligand-Target Pair |