BDBM50127499 3-[4-Carbamimidoyl-2-(2-{4-[1-(1-imino-ethyl)-piperidin-4-yloxy]-benzoylamino}-ethoxy)-phenyl]-propionic acid::CHEMBL55486
SMILES: CC(=N)N1CCC(CC1)Oc1ccc(cc1)C(=O)NCCOc1cc(ccc1CCC(O)=O)C(N)=N
InChI Key: InChIKey=YCUWTOXSHXBGEF-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Coagulation factor X (Homo sapiens (Human)) | BDBM50127499 (3-[4-Carbamimidoyl-2-(2-{4-[1-(1-imino-ethyl)-pipe...) | 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 | 330 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Ajinomoto Company Inc. Curated by ChEMBL | Assay Description Inhibitory activity against Coagulation factor X (fXa) | J Med Chem 46: 1845-57 (2003) Article DOI: 10.1021/jm020485x BindingDB Entry DOI: 10.7270/Q2PZ586C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prothrombin (Homo sapiens (Human)) | BDBM50127499 (3-[4-Carbamimidoyl-2-(2-{4-[1-(1-imino-ethyl)-pipe...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | >1.50E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Ajinomoto Company Inc. Curated by ChEMBL | Assay Description Inhibitory activity against thrombin | J Med Chem 46: 1845-57 (2003) Article DOI: 10.1021/jm020485x BindingDB Entry DOI: 10.7270/Q2PZ586C | |||||||||||
More data for this Ligand-Target Pair |