BDBM669565 US20240132477, Example 3

SMILES CN(C(C)=O)c1ccc2[nH]c(nc2c1)-c1n[nH]c2C[C@@]3(C)[C@@H](Cc12)C3(F)F

InChI Key InChIKey=HKYXSCSQSNKLKR-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 669565   

TargetTyrosine-protein kinase ITK/TSK(Human)
Pfizer

US Patent
LigandPNGBDBM669565(US20240132477, Example 3)
Affinity DataIC50: 821nMAssay Description:1.0 M HEPES Buffer pH 7.5 solution was prepared as follows: 238.3 g HEPES free acid (Sigma) and 800 mL of water were combined, and the mixture was st...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/16/2024
Entry Details
US Patent