BDBM50110745 3-(6-Carbamimidoyl-naphthalen-2-yl)-2-{4-[1-(1-imino-ethyl)-pyrrolidin-3-yloxy]-phenyl}-propionic acid::CHEMBL20506
SMILES: CC(=N)N1CCC(C1)Oc1ccc(cc1)[C@@H](Cc1ccc2cc(ccc2c1)C(N)=N)C(O)=O
InChI Key: InChIKey=FDKBUZKECUQYHR-XMMISQBUSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Coagulation factor X (Homo sapiens (Human)) | BDBM50110745 (3-(6-Carbamimidoyl-naphthalen-2-yl)-2-{4-[1-(1-imi...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 41 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Protherics Molecular Design Curated by ChEMBL | Assay Description Inhibitory concentration against human Coagulation factor Xa (fXa) | J Med Chem 45: 1221-32 (2002) BindingDB Entry DOI: 10.7270/Q2319V5W | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Trypsin (Bos taurus (bovine)) | BDBM50110745 (3-(6-Carbamimidoyl-naphthalen-2-yl)-2-{4-[1-(1-imi...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 630 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Protherics Molecular Design Curated by ChEMBL | Assay Description Inhibitory concentration against bovine trypsin | J Med Chem 45: 1221-32 (2002) BindingDB Entry DOI: 10.7270/Q2319V5W | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prothrombin (Homo sapiens (Human)) | BDBM50110745 (3-(6-Carbamimidoyl-naphthalen-2-yl)-2-{4-[1-(1-imi...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | >2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Protherics Molecular Design Curated by ChEMBL | Assay Description Inhibitory concentration against thrombin. | J Med Chem 45: 1221-32 (2002) BindingDB Entry DOI: 10.7270/Q2319V5W | |||||||||||
More data for this Ligand-Target Pair |