BDBM652695 6-N-({3-[2-(1-methylpiperidin-4-yl)ethyl]phenyl}methyl)isoquinoline-1,6-diamine::US20240059691, Example 4410

SMILES CN1CCC(CCc2cccc(CNc3ccc4c(N)nccc4c3)c2)CC1

InChI Key InChIKey=QUBLOCCBHUAIEQ-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 = 652695   

TargetCoagulation factor XII(Human)
Kalvista Pharmaceuticals

US Patent
LigandChemical structure of BindingDB Monomer ID 652695BDBM652695(US20240059691, Example 4410 | 6-N-({3-[2-(1-methyl...)
Affinity DataIC50: 650nMAssay Description:In vitro inhibition of Factor XIIa was determined using an IC50 assay based on standard literature methods (see e.g Baeriswyl et al., ACS Chem. Biol....More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2024
Entry Details
US Patent