BDBM296027 N-{[3-fluoro-5- (trifluoromethyl)phenyl] methyl}-3-[(2R)-4- hydroxy-1-[3-methoxy-4- (1H-pyrazol-4- yl)benzoyl]pyrrolidin-2- yl]benzamide::US10112939, Example 66

SMILES COc1cc(C(=O)N2CC(O)C[C@@H]2c2cccc(C(=O)NCc3cc(F)cc(C(F)(F)F)c3)c2)ccc1-c1cn[nH]c1

InChI Key InChIKey=YLHZOYUQSSIRCA-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 = 296027   

TargetRho-associated protein kinase 2(Human)
Bristol Myers Squibb

US Patent
LigandChemical structure of BindingDB Monomer ID 296027BDBM296027(US10112939, Example 66 | N-{[3-fluoro-5- (trifluor...)
Affinity DataIC50: 4.35nMpH: 7.5Assay Description:The effectiveness of compounds of the present invention as ROCK inhibitors can be determined in a 30 μL assay containing 20 mM HEPES, pH 7.5, 20...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/4/2019
Entry Details
US Patent