BDBM17338 (2S)-2-{[(2S)-1-({2-[(1S)-1-aminoethyl]-1,3-oxazol-4-yl}carbonyl)pyrrolidin-2-yl]formamido}-3-(1H-indol-3-yl)propanoic acid::AoxSPW
SMILES: C[C@H](N)c1nc(co1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
InChI Key: InChIKey=FBRCDLGEWAXPMI-IWEFOYFVSA-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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XIAP-BIR3 (Homo sapiens (Human)) | BDBM17338![]() ((2S)-2-{[(2S)-1-({2-[(1S)-1-aminoethyl]-1,3-oxazol...) | PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar | MMDB PC cid PC sid PDB UniChem Similars | MMDB PDB Article PubMed | n/a | n/a | n/a | 3.00E+4 | n/a | n/a | n/a | 7.0 | 22 |
Princeton University | Assay Description AVPC-badan can be displaced from the binding pocket of the protein by test compounds. As the dye is displaced from the binding pocket, the emission i... | Bioorg Med Chem 15: 2935-43 (2007) Article DOI: 10.1016/j.bmc.2007.02.010 BindingDB Entry DOI: 10.7270/Q2KS6PT4 | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) |