Reaction Details Report a problem with these data
Target
Tissue factor
Ligand
BDBM50293375
Substrate
n/a
Meas. Tech.
ChEMBL_572140 (CHEMBL1024282)
IC50
27700±n/a nM
Citation
Ayral, E; Gloanec, P; Bergé, G; de Nanteuil, G; Mennecier, P; Rupin, A; Verbeuren, TJ; Fulcrand, P; Martinez, J; Hernandez, JF Design, synthesis, and biological evaluation of 1,5-benzothiazepine-4-one derivatives targeting factor VIIa/tissue factor. Bioorg Med Chem Lett 19:1386-91 (2009) [PubMed] Article
More Info.:
Target
Name:
Tissue factor
Synonyms:
CD_antigen=CD142 | Coagulation factor III | Coagulation factor VII/tissue factor | F3 | TF | TF_HUMAN | Thromboplastin | Tissue factor
Type:
PROTEIN
Mol. Mass.:
33067.61
Organism:
Homo sapiens (Human)
Description:
ChEMBL_936735
Residue:
295
Sequence:
METPAWPRVPRPETAVARTLLLGWVFAQVAGASGTTNTVAAYNLTWKSTNFKTILEWEPKPVNQVYTVQISTKSGDWKSKCFYTTDTECDLTDEIVKDVKQTYLARVFSYPAGNVESTGSAGEPLYENSPEFTPYLETNLGQPTIQSFEQVGTKVNVTVEDERTLVRRNNTFLSLRDVFGKDLIYTLYYWKSSSSGKKTAKTNTNEFLIDVDKGENYCFSVQAVIPSRTVNRKSTDSPVECMGQEKGEFREIFYIIGAVVFVVIILVIILAISLHKCRKAGVGQSWKENSPLNVS
Inhibitor
Name:
BDBM50293375
Synonyms:
(R)-4-(5-(2-(4-carbamimidoylbenzylamino)-2-oxoethyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-ylamino)-4-oxobutanoic acid, trifluoroacetic acid | CHEMBL557679
Type:
Small organic molecule
Emp. Form.:
C23H25N5O5S
Mol. Mass.:
483.54
SMILES:
NC(=N)c1ccc(CNC(=O)CN2c3ccccc3SC[C@H](NC(=O)CCC(O)=O)C2=O)cc1 |r|