BDBM652531 N5-((6-(3-(2,2-difluoroethyl)pyrrolidin-1-yl)pyridin-3-yl)methyl)isoquinoline-1,5-diamine::US20240059691, Example 1265

SMILES Nc1nccc2c(NCc3ccc(nc3)N3CCC(CC(F)F)C3)cccc12

InChI Key InChIKey=MVLCYOKJALGQGT-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 652531   

TargetCoagulation factor XII(Human)
Kalvista Pharmaceuticals

US Patent
LigandChemical structure of BindingDB Monomer ID 652531BDBM652531(US20240059691, Example 1265 | N5-((6-(3-(2,2-diflu...)
Affinity DataIC50: 6.50E+3nMAssay 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

TargetPlasma kallikrein(Human)
Kalvista Pharmaceuticals

US Patent
LigandChemical structure of BindingDB Monomer ID 652531BDBM652531(US20240059691, Example 1265 | N5-((6-(3-(2,2-diflu...)
Affinity DataIC50: 7.00E+4nMAssay Description:In vitro inhibition of related proteases was determined using an (C50 assay based on standard literature methods (see e.g. Shori et al., Biochem. Pha...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2024
Entry Details
US Patent