BDBM50003738 (lactone 2)N-[4-(6-Iodomethylene-2-oxo-tetrahydro-pyran-3-yl)-benzyl]-guanidine::CHEMBL135723
SMILES: NC(=N)NCc1ccc(cc1)C1CC\C(OC1=O)=C\I
InChI Key: InChIKey=HNGQAWXKSWVXIP-XFFZJAGNSA-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 |
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Urokinase-type plasminogen activator (Homo sapiens (Human)) | BDBM50003738 ((lactone 2)N-[4-(6-Iodomethylene-2-oxo-tetrahydro-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois Curated by ChEMBL | Assay Description Compound was tested for its binding affinity against the enzyme Urokinase-type plasminogen activator | J Med Chem 35: 4297-305 (1992) BindingDB Entry DOI: 10.7270/Q2TD9W9D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Trypsin (Bos taurus (bovine)) | BDBM50003738 ((lactone 2)N-[4-(6-Iodomethylene-2-oxo-tetrahydro-...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois Curated by ChEMBL | Assay Description Compound was tested for its binding affinity against the enzyme trypsin | J Med Chem 35: 4297-305 (1992) BindingDB Entry DOI: 10.7270/Q2TD9W9D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Tissue-type plasminogen activator (Homo sapiens (Human)) | BDBM50003738 ((lactone 2)N-[4-(6-Iodomethylene-2-oxo-tetrahydro-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois Curated by ChEMBL | Assay Description Compound was tested for its binding affinity against the enzyme Tissue plasminogen activator | J Med Chem 35: 4297-305 (1992) BindingDB Entry DOI: 10.7270/Q2TD9W9D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Plasminogen (Homo sapiens (Human)) | BDBM50003738 ((lactone 2)N-[4-(6-Iodomethylene-2-oxo-tetrahydro-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.19E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois Curated by ChEMBL | Assay Description Compound was tested for its binding affinity against the enzyme plasmin | J Med Chem 35: 4297-305 (1992) BindingDB Entry DOI: 10.7270/Q2TD9W9D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prothrombin (Homo sapiens (Human)) | BDBM50003738 ((lactone 2)N-[4-(6-Iodomethylene-2-oxo-tetrahydro-...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois Curated by ChEMBL | Assay Description Compound was tested for its binding affinity against the enzyme thrombin | J Med Chem 35: 4297-305 (1992) BindingDB Entry DOI: 10.7270/Q2TD9W9D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prothrombin (Homo sapiens (Human)) | BDBM50003738 ((lactone 2)N-[4-(6-Iodomethylene-2-oxo-tetrahydro-...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | 0.0130 | n/a | n/a | n/a | n/a | n/a |
University of Illinois Curated by ChEMBL | Assay Description Compound was tested for the rate constant of deacylation against thrombin | J Med Chem 35: 4297-305 (1992) BindingDB Entry DOI: 10.7270/Q2TD9W9D | |||||||||||
More data for this Ligand-Target Pair |