BDBM50253934 2-Benzyl-3-{2-[(4-carbamimidoylphenoxy)methyl]-2,4-dimethyl-3,4-dihydro-2H-1,4-benzoxazin-7-ylamino}-3-oxopropanoic acid::CHEMBL517551
SMILES: CN1CC(C)(COc2ccc(cc2)C(N)=N)Oc2cc(NC(=O)C(Cc3ccccc3)C(O)=O)ccc12
InChI Key: InChIKey=CLBIPVQEMSMMJN-UHFFFAOYSA-N
Data: 1 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 |
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Prothrombin (Homo sapiens (Human)) | BDBM50253934![]() (2-Benzyl-3-{2-[(4-carbamimidoylphenoxy)methyl]-2,4...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Ljubljana Curated by ChEMBL | Assay Description Inhibition of thrombin (unknown origin) | J Med Chem 51: 5617-29 (2008) Article DOI: 10.1021/jm8003448 BindingDB Entry DOI: 10.7270/Q2JQ10TZ | |||||||||||
More data for this Ligand-Target Pair |