BDBM526605 (E)-1-(4-(dimethylamino)-4-oxobut-2-en-1-yl)-N-(3-(((8-isopropyl-2-((tetrahydro- 2H-pyran-4-yl)amino)pyrazolo[1,5-a][1,3,5]triazin-4-yl)amino)methyl) phenyl)azetidine-2-carboxamide::US11186576, Compound 76.

SMILES CC(C)c1cnn2c(NCc3cccc(NC(=O)C4CCN4C\C=C\C(=O)N(C)C)c3)nc(NC3CCOCC3)nc12

InChI Key InChIKey=YQHICWQULKSENB-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 = 526605   

TargetCDK-activating kinase assembly factor MAT1/Cyclin-H/Cyclin-dependent kinase 7(Human)
Aurigene Discovery Technologies

US Patent
LigandChemical structure of BindingDB Monomer ID 526605BDBM526605((E)-1-(4-(dimethylamino)-4-oxobut-2-en-1-yl)-N-(3-...)
Affinity DataIC50: 1.00E+3nMAssay Description:The ability of compounds to inhibit CDK7 kinase activity was tested in a TR-FRET assay using 5 nM of CDK7/CycH/MNAT1 obtained from Invitrogen, USA. T...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/10/2022
Entry Details
US Patent