BDBM243122 (S)-N-((S)-7-cyano-1-((3- cyclopropylquinolin-4-yl)methyl)-5- isonicotinoyl-2-oxo-2,3,4,5-tetrahydro- 1H-benzo[bl[1,4]diazepin-3-yl)-2- (methylamino)propanamide::US10053431, 181

SMILES CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccncc2)c2cc(ccc2N(Cc2c(cnc3ccccc23)C2CC2)C1=O)C#N

InChI Key InChIKey=LKTPSSFKOOCJLH-MMTVBGGISA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 243122   

TargetE3 ubiquitin-protein ligase XIAP [241-356](Homo sapiens (Human))
Hoffmann-La Roche

US Patent
LigandPNGBDBM243122((S)-N-((S)-7-cyano-1-((3- cyclopropylquinolin-4-yl...)
Affinity DataIC50:  1.63E+4nMpH: 7.5 T: 2°CAssay Description:Ten nanomolar of 6× Histidine-tagged BIR2 domain, corresponding to amino acids 124-240 of XIAP, or BIR3 domain, corresponding to amino acids 241-356 ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetE3 ubiquitin-protein ligase XIAP [124-240](Homo sapiens (Human))
Hoffmann-La Roche

US Patent
LigandPNGBDBM243122((S)-N-((S)-7-cyano-1-((3- cyclopropylquinolin-4-yl...)
Affinity DataIC50:  16.9nMpH: 7.5 T: 2°CAssay Description:Ten nanomolar of 6× Histidine-tagged BIR2 domain, corresponding to amino acids 124-240 of XIAP, or BIR3 domain, corresponding to amino acids 241-356 ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent