BDBM50136247 (S)-3-(2,3-Dihydro-benzofuran-6-yl)-3-{(R)-2-oxo-3-[3-(5,6,7,8-tetrahydro-[1,8]naphthyridin-2-yl)-propyl]-pyrrolidin-1-yl}-propionic acid::CHEMBL135757
SMILES: OC(=O)C[C@H](N1CC[C@@H](CCCc2ccc3CCCNc3n2)C1=O)c1ccc2CCOc2c1
InChI Key: InChIKey=YWGKJZDMSJRNNY-KNQAVFIVSA-N
Data: 1 IC50
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-V/beta-3 (Homo sapiens (Human)) | BDBM50136247 ((S)-3-(2,3-Dihydro-benzofuran-6-yl)-3-{(R)-2-oxo-3...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 0.390 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Displacement of [125I]-labeled nonpeptide from purified recombinant human alphaV-beta3 integrin | Bioorg Med Chem Lett 13: 4285-8 (2003) BindingDB Entry DOI: 10.7270/Q25D8T08 | |||||||||||
More data for this Ligand-Target Pair |