BDBM553642 (3,3-difluorocyclobutyl) 4-[5-[[4-(difluoromethyl)- 6-oxo-1H-pyridine-3- carbonyl]amino]-2- fluoro-4-[rac-(3R,5S)- 3,4,5-trimethylpiperazin- 1-yl]phenyl]-2,3,6,7- tetrahydroazepine-1- carboxylate::US11319299, Example 730

SMILES C[C@@H]1CN(c2cc(F)c(C3=CCCN(C(=O)OC4CC(F)(F)C4)CC3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)F)C[C@H](C)N1C

InChI Key InChIKey=HVHIJYYQVAOAFO-UHFFFAOYSA-N

Data  1 Kd

  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 = 553642   

TargetWD repeat-containing protein 5(Human)
Propellon Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 553642BDBM553642((3,3-difluorocyclobutyl) 4-[5-[[4-(difluoromethyl)...)
Affinity DataKd:  7.99nMAssay Description:Exemplary compounds of the application were dissolved in 100% DMSO at 10 mM, assayed fresh, and then stored at −20° C. for repeat studies and o...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/7/2022
Entry Details
US Patent