BDBM44257 MLS-0390899.0001::N-(diphenylmethyl)-1-[3-methyl-2-[2-(methylamino)propanoylamino]butanoyl]pyrrolidine-2-carboxamide;2,2,2-tris(fluoranyl)ethanoic acid::N-(diphenylmethyl)-1-[3-methyl-2-[[2-(methylamino)-1-oxopropyl]amino]-1-oxobutyl]-2-pyrrolidinecarboxamide;2,2,2-trifluoroacetic acid::N-benzhydryl-1-[3-methyl-2-[2-(methylamino)propanoylamino]butanoyl]pyrrolidine-2-carboxamide;2,2,2-trifluoroacetic acid::cid_25199549
SMILES: CNC(C)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(c1ccccc1)c1ccccc1
InChI Key: InChIKey=SOWOWEPRDWOROA-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
X-linked inhibitor of apoptosis protein (XIAP) (Homo sapiens (Human)) | BDBM44257 (MLS-0390899.0001 | N-(diphenylmethyl)-1-[3-methyl-...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q29W0CWK | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
X-linked inhibitor of apoptosis protein (XIAP) (Homo sapiens (Human)) | BDBM44257 (MLS-0390899.0001 | N-(diphenylmethyl)-1-[3-methyl-...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 3.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2FN14KV | |||||||||||
More data for this Ligand-Target Pair |