BDBM695972 6-(5-azaspiro[2.4]heptan-5-ylmethyl)-2- cyclopropyl-N-(3-((1R,2S)-1,2-difluoro- 1-(4-methyl-4H-1,2,4-triazol-3- yl)propan-2-yl)phenyl)pyrimidine-4- carboxamide::US20240300927, Compound 41

SMILES Cn1cnnc1[C@@H](F)[C@@](C)(F)c1cccc(NC(=O)c2cc(CN3CCC4(CC4)C3)nc(n2)C2CC2)c1

InChI Key InChIKey=YTFMMNXLFSPQAG-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 695972   

LigandChemical structure of BindingDB Monomer ID 695972BDBM695972(US20240300927, Compound 41 | 6-(5-azaspiro[2.4]hep...)
Affinity DataIC50: 4.80E+3nMAssay Description: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 concentrat...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
1/8/2025
Entry Details
US Patent

LigandChemical structure of BindingDB Monomer ID 695972BDBM695972(US20240300927, Compound 41 | 6-(5-azaspiro[2.4]hep...)
Affinity DataIC50: 1.20E+4nMAssay Description: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 concentrat...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
1/8/2025
Entry Details
US Patent