Brief Information of the Compound and Protein
Compound Name
3,5-dimethyl-4-[2-[[1-[(4-methylsulfonylphenyl)methyl]piperidin-4-yl]amino]-5-(phenylmethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-yl]oxybenzonitrile
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PubChem ID
CID: 145982446
Canonical SMILES
Cc1cc(cc(C)c1Oc1nc(NC2CCN(Cc3ccc(cc3)S(C)(=O)=O)CC2)nc2ccn(COCc3ccccc3)c12)C#N
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Compound Formula C36H38N6O4S
Compound Structure
Protein Name
Reverse transcriptase/RNaseH
Protein Classification
Enzyme
>
Hydrolase
Uniprot ID
Q72547
Gene Name
POL
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000247 MT-4 Homo sapiens (Human)  3
1
EC50 = 26.3 nM
   TI
   LI
   LO
   TS
2
EC50 = 547 nM
   TI
   LI
   LO
   TS
3
IC50 = 189 nM
   TI
   LI
   LO
   TS