BDBM452920 7-methyl-1-[[3- [(1R,5R,6S)-3-(2,3,4- trifluorophenyl)-6- bicyclo[3.1.0]hex-2- enyl]-1,2,4- oxadiazol-5-yl] methyl]purin-6-one::US10711004, Example 242::US10711004, Example 274

SMILES Cn1cnc2ncn(Cc3nc(no3)[C@H]3[C@@H]4CC(=C[C@H]34)c3ccc(F)c(F)c3F)c(=O)c12

InChI Key InChIKey=LDLLVRCAPFWYTL-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 452920   

LigandPNGBDBM452920(US10711004, Example 242 | 7-methyl-1-[[3- [(1R,5R,...)
Affinity DataIC50: 19.1nMAssay Description:The IC50 (effective concentration) of compounds on the human TRPA1 channel was determined using a FLIPR Tetra instrument. CHO cells expressing TRPA1 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/14/2021
Entry Details
Go to US Patent

LigandPNGBDBM452920(US10711004, Example 242 | 7-methyl-1-[[3- [(1R,5R,...)
Affinity DataIC50: 6.30nMAssay Description:The IC50 (effective concentration) of compounds on the human TRPA1 channel was determined using a FLIPR Tetra instrument. CHO cells expressing TRPA1 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/14/2021
Entry Details
Go to US Patent

LigandPNGBDBM452920(US10711004, Example 242 | 7-methyl-1-[[3- [(1R,5R,...)
Affinity DataIC50: 19.1nMAssay Description:The IC50 (effective concentration) of compounds on the human TRPA1 channel was determined using a FLIPR Tetra instrument. CHO cells expressing TRPA1 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/14/2021
Entry Details
Go to US Patent

LigandPNGBDBM452920(US10711004, Example 242 | 7-methyl-1-[[3- [(1R,5R,...)
Affinity DataIC50: 6.30nMAssay Description:The IC50 (effective concentration) of compounds on the human TRPA1 channel was determined using a FLIPR Tetra instrument. CHO cells expressing TRPA1 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/14/2021
Entry Details
Go to US Patent