BDBM595572 (S)-1-(5-(((R)-2-(((1r,4R)-4-((5′-chloro-6-(((4-cyanotetrahydro-2H-pyran-4-yl)methyl)amino)-[2,4′-bipyridin]-2′-yl)amino)cyclohexyl)amino)propoxy)methyl)-1H-tetrazol-1-yl)ethyl ethyl carbonate (Compound 30) and (S)-1-(5-(((S)-2-(((1r,4S)-4-((5′-chloro-6-(((4-cyanotetrahydro-2H-pyran-4-yl)methyl)amino)-[2,4′-bipyridin]-2′-yl)amino)cyclohexyl)amino)propoxy)methyl)-1H-tetrazol-1-yl)ethyl ethyl carbonate ::US11591322, Compound 31

SMILES CCOC(=O)O[C@@H](C)n1nnnc1COC[C@H](C)N[C@H]1CC[C@H](Nc2cc(-c3cccc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1

InChI Key InChIKey=ZYDWKIUKYSKYNN-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 595572   

TargetCyclin-T1/Cyclin-dependent kinase 9(Human)
Algen Biotechnologies

US Patent
LigandChemical structure of BindingDB Monomer ID 595572BDBM595572(US11591322, Compound 31 | (S)-1-(5-(((R)-2-(((1r,4...)
Affinity DataIC50: 2.5nMAssay Description:To each well of a 96-well plate was added 5× kinase assay buffer with 10 mM DTT (6 μL), 500 μM ATP (1 μL), 5×CDK substrate (10 μL...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/14/2023
Entry Details
US Patent