BDBM50406172 CHEMBL5290426::US20240190892, Example 4

SMILES C[C@H]1CCN(C1)c1ccc(CNC(=O)c2cnnc(c2)N2CC[C@]3(C2)OC(=O)Nc2ccc(Cl)c(F)c32)cn1

InChI Key InChIKey=GNTRWDCZPQTGAV-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50406172   

TargetPlasma kallikrein(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM50406172(CHEMBL5290426 | US20240190892, Example 4)
Affinity DataIC50: 1.20nMAssay Description:Inhibition of human plasma kallikrein using Acetyl-K- P-R-AFC as substrate by fluorescence based analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
TargetPlasma kallikrein(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM50406172(CHEMBL5290426 | US20240190892, Example 4)
Affinity DataIC50: 7.44E+3nMAssay Description:Inhibition of human factor 11a using GPR-AFC as substrate preincubated for 30 mins followed by substrate addition and measured after 60 mins by fluor...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
TargetPlasma kallikrein(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM50406172(CHEMBL5290426 | US20240190892, Example 4)
Affinity DataIC50: 1.20nMAssay Description:The effectiveness of a compound of the present invention as an inhibitor of plasma kallikrein can be determined using a relevant purified serine prot...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2024
Entry Details
Go to US Patent

TargetCoagulation factor XI(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM50406172(CHEMBL5290426 | US20240190892, Example 4)
Affinity DataIC50: 7.44E+3nMAssay Description:The effectiveness of a compound of the present invention as an inhibitor of Coagulation factor XIa can be determined using a relevant purified serine...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2024
Entry Details
Go to US Patent