BDBM42557 2-(7-acryloyl-5-(4- amino-6- (trifluoromethyl) nicotinoyl)- 3,4,5,5a,6,7,8,9- octahydro-2H-1,2,5,7- tetraazabenzo[cd]azulen- 2-yl)-5- cyclobutylbenzonitrile::US20250346600, Compound 171

SMILES C=CC(=O)N1CCc2nn(-c3ccc(C4CCC4)cc3C#N)c3c2C(C1)N(C(=O)c1cnc(C(F)(F)F)cc1N)CC3

InChI Key InChIKey=BMABHLCCGUBBJN-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 = 42557   

LigandChemical structure of BindingDB Monomer ID 42557BDBM42557(2-(7-acryloyl-5-(4- amino-6- (trifluoromethyl) nic...)
Affinity DataIC50: 35nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute (TSRI) Assay Provid...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2026
Entry Details
US Patent