BDBM50003330 (5-{[2-(Benzoyl-methyl-amino)-5-guanidino-pentanoylamino]-methyl}-2-oxo-1-phenyl-2,3,6,7-tetrahydro-1H-azepin-3-yl)-acetic acid::CHEMBL423881
SMILES: CN(C(CCCNC(N)=N)C(=O)NCC1=CC(CC(O)=O)C(=O)N(CC1)c1ccccc1)C(=O)c1ccccc1
InChI Key: InChIKey=NCXZETWOZDSFLY-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Integrin alpha-IIb/beta-3 (Homo sapiens (Human)) | BDBM50003330 ((5-{[2-(Benzoyl-methyl-amino)-5-guanidino-pentanoy...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 106 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SmithKline Beecham Pharmaceuticals Curated by ChEMBL | Assay Description Inhibition of [3H]-107260 binding to purified GPIIb/IIIa of human platelets | J Med Chem 35: 3970-2 (1992) BindingDB Entry DOI: 10.7270/Q2V9871V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Integrin alpha-IIb/beta-3 (Homo sapiens (Human)) | BDBM50003330 ((5-{[2-(Benzoyl-methyl-amino)-5-guanidino-pentanoy...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
SmithKline Beecham Pharmaceuticals Curated by ChEMBL | Assay Description Inhibition of [3H]-107260 binding to purified GPIIb/IIIa of human platelets | J Med Chem 35: 3970-2 (1992) BindingDB Entry DOI: 10.7270/Q2V9871V | |||||||||||
More data for this Ligand-Target Pair |