Brief Information of the Compound and Protein
Compound Name
3,5-Dimethyl-4-((2-((4-((4-nitrobenzyl)amino)cyclohexyl)amino)-thieno[3,2-d]pyrimidin-4-yl)oxy)benzonitrile
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PubChem ID
CID: 129908820
Canonical SMILES
Cc1cc(C#N)cc(C)c1Oc1nc(NC2CCC(NCc3ccc([N+](=O)[O-])cc3)CC2)nc2ccsc12
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Compound Formula C28H28N6O3S
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)  7
1
EC50 = 158 nM
   TI
   LI
   LO
   TS
2
EC50 = 646 nM
   TI
   LI
   LO
   TS
3
EC50 = 690 nM
   TI
   LI
   LO
   TS
4
EC50 = 1550 nM
   TI
   LI
   LO
   TS
5
EC50 = 11100 nM
   TI
   LI
   LO
   TS
6
EC50 >= 26500 nM
   TI
   LI
   LO
   TS
7
EC50 >= 54400 nM
   TI
   LI
   LO
   TS