Brief Information of the Compound and Protein
Compound Name
[4-[2-[1-(2-hydroxyethyl)piperidin-4-yl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-3-methoxyphenyl]-pyrrolidin-1-ylmethanone
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PubChem ID
CID: 168288718
Canonical SMILES
COc1cc(ccc1-c1ccnc2[nH]c(cc12)C1CCN(CCO)CC1)C(=O)N1CCCC1
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Compound Formula C26H32N4O3
Compound Structure
Protein Name
Cyclin-dependent kinase 9
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
CMGC protein kinase group
>
CMGC protein kinase CDK family
>
CMGC protein kinase CDK9 subfamily
Uniprot ID
P50750
Gene Name
CDK9
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000083 MCF-7 Homo sapiens (Human)  1
1
IC50 = 130 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 4 nM