BDBM710895 (S)-2-(3-(1-(4-methyl-4H-1,2,4-triazol-3- yl)-2-(tetrahydro-2H-pyran-4- yl)ethyl)phenyl)-6-(((1- methylcyclobutyl)amino)methyl)-4- (trifluoromethyl)isoindolin-1-one::US12187709, Compound 253

SMILES Cn1cnnc1[C@@H](CC1CCOCC1)c1cccc(N2Cc3c(cc(CNC4(C)CCC4)cc3C(F)(F)F)C2=O)c1

InChI Key InChIKey=XNPAIRJJRXSASD-UHFFFAOYSA-N

  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 = 710895   

LigandChemical structure of BindingDB Monomer ID 710895BDBM710895((S)-2-(3-(1-(4-methyl-4H-1,2,4-triazol-3- yl)-2-(t...)
Affinity DataIC50: 120nMAssay Description:Table 3: Compounds were 3-fold serially diluted in DMSO in a 384-well polypropylene plate (#P-05525-BC; Labcyte) to generate a source plate with 10 c...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
5/19/2025
Entry Details
US Patent

LigandChemical structure of BindingDB Monomer ID 710895BDBM710895((S)-2-(3-(1-(4-methyl-4H-1,2,4-triazol-3- yl)-2-(t...)
Affinity DataIC50: 140nMAssay Description:Table 3: Compounds were 3-fold serially diluted in DMSO in a 384-well polypropylene plate (#P-05525-BC; Labcyte) to generate a source plate with 10 c...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
5/19/2025
Entry Details
US Patent