BDBM646117 ((1R,2R,4S)-2-amino-7- azabicyclo[2.2.1]heptan-7-yl)(1- cyclopropyl-2-(1- (cyclopropylmethyl)-6-((S)-3- methyl-1,1-dioxido-1,2- thiazinan-2-yl)-1H- pyrrolo[2,3-b]pyridin-2-yl)-7- methoxy-1H-benzo[d]imidazol- 5-yl)methanone::US11878965, Example 102

SMILES COc1cc(cc2nc(-c3cc4ccc(cc4n3CC3CC3)N3[C@@H](C)CCCS3(=O)=O)n(C3CC3)c12)C(=O)N1[C@H]2CC[C@@H]1[C@H](N)C2

InChI Key

Data  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 1 hit for monomerid = 646117   

TargetProtein-arginine deiminase type-4(Human)
Gilead Sciences

US Patent
LigandPNGBDBM646117(US11878965, Example 102 | ((1R,2R,4S)-2-amino-7- a...)
Affinity DataIC50: 42nMAssay Description:One hundred nanoliters of test compounds dissolved in DMSO at various concentrations were dispensed into a 384-well black OptiPlate using a Labcyte E...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/14/2024
Entry Details
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