BDBM401487 (R)-1-(2-(4-(2-(pyrrolidin-1- ylmethyl)-4- (trifluoromethyl)phenoxy)phenyl) pyrimidin-4-yl)ethane-1,2-diol::US10005768, Compound 115

SMILES OC[C@H](O)c1ccnc(n1)-c1ccc(Oc2ccc(cc2CN2CCCC2)C(F)(F)F)cc1

InChI Key InChIKey=GJGDYXPJGJLEIR-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 401487   

TargetSodium channel protein type 9 subunit alpha(Human)
Purdue Pharma

US Patent
LigandPNGBDBM401487(US10005768, Compound 115 | (R)-1-(2-(4-(2-(pyrroli...)
Affinity DataIC50: 455nMAssay Description:The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL of 10×HBSS th...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/18/2020
Entry Details
Go to US Patent