BDBM583160 (1R,4R,7R)-2-{2-[1- (cyclopropylmethyl)-6-[(2- methylpyridin-4-yl)amino]-1H- pyrrolo[2,3-b]pyridin-2-yl]-7- methoxy-1-methyl-1H-1,3- benzodiazole-5-carbonyl}-2- azabicyclo[2.2.1]heptan-7-amine::US11524959, Compound 52.

SMILES COc1cc(cc2nc(-c3cc4ccc(Nc5ccnc(C)c5)nc4n3CC3CC3)n(C)c12)C(=O)N1CC2CCC1[C@@H]2N

InChI Key InChIKey=PJRUQHONKKWUMK-UHFFFAOYSA-N

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 = 583160   

TargetProtein-arginine deiminase type-4(Human)
Bristol-Myers Squibb

US Patent
LigandPNGBDBM583160(US11524959, Compound 52. | (1R,4R,7R)-2-{2-[1- (cy...)
Affinity DataIC50: 18nMAssay Description:Compounds were solubilized in 100% DMSO to achieve a 10 mM compound concentration. Compound stock solutions were stored at RT. A series of dilutions ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2023
Entry Details
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