BDBM50078436 (S)-2-(2-Ethoxy-ethanesulfonylamino)-3-{[5-(2-piperidin-4-yl-ethyl)-thieno[2,3-b]thiophene-2-carbonyl]-amino}-propionic acid::CHEMBL79211
SMILES: CCOCCS(=O)(=O)N[C@@H](CNC(=O)c1cc2cc(CCC3CCNCC3)sc2s1)C(O)=O
InChI Key: InChIKey=ONCDSJSLWNCDLA-KRWDZBQOSA-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 |
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Integrin alpha-IIb/beta-3 (Homo sapiens (Human)) | BDBM50078436 ((S)-2-(2-Ethoxy-ethanesulfonylamino)-3-{[5-(2-pipe...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description The compound was tested in vivo for the inhibition of aggregation of human gel-filtered platelets(GFP) | J Med Chem 42: 2409-21 (1999) Article DOI: 10.1021/jm980722p BindingDB Entry DOI: 10.7270/Q2HH6J8X | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Integrin alpha-IIb/beta-3 (Homo sapiens (Human)) | BDBM50078436 ((S)-2-(2-Ethoxy-ethanesulfonylamino)-3-{[5-(2-pipe...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Displacement of L-762,745 from Fibrinogen Receptor of human platelets by flow cytometry | J Med Chem 42: 2409-21 (1999) Article DOI: 10.1021/jm980722p BindingDB Entry DOI: 10.7270/Q2HH6J8X | |||||||||||
More data for this Ligand-Target Pair |