BDBM44288 (2S)-N-[(1S)-1-[(3-fluoroanilino)carbamoyl]-2-methyl-propyl]-3-methyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butyramide;formic acid::(2S)-N-[(2S)-1-[(3-fluorophenyl)hydrazo]-3-methyl-1-oxobutan-2-yl]-3-methyl-2-[[(2S)-2-(methylamino)-1-oxopropyl]amino]butanamide;formic acid::(2S)-N-[(2S)-1-[2-(3-fluorophenyl)hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-methyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanamide;methanoic acid::(2S)-N-[(2S)-1-[2-(3-fluorophenyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]-3-methyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanamide;formic acid::CHEMBL1619873::MLS-0412062.0001::cid_44176344

SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NNc1cccc(F)c1

InChI Key InChIKey=QLHGYYFTMYAHLC-JQFCIGGWSA-N

Data  2 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 44288   

TargetE3 ubiquitin-protein ligase XIAP(Human)
Sanford-Burnham Medical Research Institute

Curated by ChEMBL
LigandPNGBDBM44288((2S)-N-[(1S)-1-[(3-fluoroanilino)carbamoyl]-2-meth...)
Affinity DataKi:  2.38E+3nMAssay Description:Competitive inhibition of XIAP-BIR2 domain (unknown origin) by fluorescence polarization assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
Sanford-Burnham Medical Research Institute

Curated by ChEMBL
LigandPNGBDBM44288((2S)-N-[(1S)-1-[(3-fluoroanilino)carbamoyl]-2-meth...)
Affinity DataKi: >3.90E+4nMAssay Description:Competitive inhibition of XIAP-BIR3 domain (unknown origin) by fluorescence polarization assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
Sanford-Burnham Medical Research Institute

Curated by ChEMBL
LigandPNGBDBM44288((2S)-N-[(1S)-1-[(3-fluoroanilino)carbamoyl]-2-meth...)
Affinity DataIC50:  4.90E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay