BDBM646078 N-(2-(5-((1R,2R,4S)-2- amino-7-azabicyclo[2.2.1] heptane-7-carbonyl)- 7-methoxy-1-methyl-1H- benzo[d]imidazol-2-yl)-1- (cyclopropylmethyl)-1H-pyrrolo [2,3-b]pyridin-6-yl)-N- (difluoromethyl) methanesulfonamide::US11878965, Example 63

SMILES COc1cc(cc2nc(-c3cc4ccc(nc4n3CC3CC3)N(C(F)F)S(C)(=O)=O)n(C)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
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 1 hit for monomerid = 646078   

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

US Patent
LigandPNGBDBM646078(US11878965, Example 63 | N-(2-(5-((1R,2R,4S)-2- am...)
Affinity DataIC50: 45.1nMAssay 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
Go to US Patent