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Literature summary for 2.7.11.22 extracted from
- 5-Substituted 3-isopropyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidines with anti-proliferative activity as potent and selective inhibitors of cyclin-dependent kinases (2016), Eur. J. Med. Chem., 110, 291-301.
Cloned(Commentary)
| Cloned (Comment) | Organism |
|---|---|
| expressed in Sf9 insect cells | Homo sapiens |
Inhibitors
| Inhibitors | Comment | Organism | Structure |
|---|---|---|---|
| (2R)-2-{[9-(propan-2-yl)-6-({[4-(pyridin-2-yl)phenyl]methyl}amino)-9H-purin-2-yl]amino}butan-1-ol | - |
Homo sapiens |  |
| 3-isopropyl-5(R)-(2-hydroxypropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5(R)-[1-(hydroxymethyl)propyl]amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5,7-di[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(2,3-dihydroxypropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(2-aminoethyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(2-hydroxy-2-methylpropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(2-hydroxyethyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(3-amino-2-hydroxypropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(4-methoxybenzyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(N-morpholinyl)-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(piperazin-1-yl)-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(thiomorpholinyl)-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(trans-2-aminocyclohexyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-(trans-4-aminocyclohexyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-methylsulfanyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-methylsulfonyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-[2-(2-hydroxyethyl)piperidin-1-yl]-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-[2-(dimethylamino)ethyl]amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-5-[4-(2-hydroxyethyl)piperazin-1-yl]-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| 3-isopropyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | - |
Homo sapiens | |
| BS-181 | - |
Homo sapiens | |
| dinaciclib | - |
Homo sapiens | |
| flavopiridol | - |
Homo sapiens | |
| LDC000067 | - |
Homo sapiens | |
| N-(3-{[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]amino}phenyl)-4-{[(2E)-4-(dimethylamino)but-2-enoyl]amino}benzamide | - |
Homo sapiens | |
| palbociclib | - |
Homo sapiens | |
| PD-0332991 | - |
Homo sapiens | |
| roscovitine | - |
Homo sapiens | |
| SCH-727965 | - |
Homo sapiens | |
Natural Substrates/ Products (Substrates)
| Natural Substrates | Organism | Comment (Nat. Sub.) | Natural Products | Comment (Nat. Pro.) | Rev. | Reac. |
|---|---|---|---|---|---|---|
| ATP + a protein | Homo sapiens | - |
ADP + phosphorylated protein | - |
? | |
Organism
| Organism | UniProt | Comment | Textmining |
|---|---|---|---|
| Homo sapiens | - |
- |
- |
Purification (Commentary)
| Purification (Comment) | Organism |
|---|---|
| Ni-NTA column chromatography | Homo sapiens |
Source Tissue
| Source Tissue | Comment | Organism | Textmining |
|---|---|---|---|
| G-361 cell | - |
Homo sapiens | - |
| HCT-116 cell | - |
Homo sapiens | - |
| K-562 cell | - |
Homo sapiens | - |
| MCF-7 cell | - |
Homo sapiens | - |
Substrates and Products (Substrate)
| Substrates | Comment Substrates | Organism | Products | Comment (Products) | Rev. | Reac. |
|---|---|---|---|---|---|---|
| ATP + a protein | - |
Homo sapiens | ADP + phosphorylated protein | - |
? | |
Synonyms
| Synonyms | Comment | Organism |
|---|---|---|
| CDK2 | isoform | Homo sapiens |
| Cdk5 | isoform | Homo sapiens |
IC50 Value
| IC50 Value | IC50 Value Maximum | Comment | Organism | Inhibitor | Structure |
|---|---|---|---|---|---|
| 0.000001 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(2-hydroxy-2-methylpropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000005 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5(R)-(2-hydroxypropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000005 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(N-morpholinyl)-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000008 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(2-aminoethyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000009 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(2-hydroxy-2-methylpropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000009 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5(R)-[1-(hydroxymethyl)propyl]amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000012 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(2,3-dihydroxypropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000017 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(3-amino-2-hydroxypropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000018 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(N-morpholinyl)-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000018 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(2-aminoethyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000021 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5(R)-(2-hydroxypropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000021 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(2,3-dihydroxypropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000024 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-[2-(2-hydroxyethyl)piperidin-1-yl]-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000031 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(2-hydroxyethyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000037 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-[2-(2-hydroxyethyl)piperidin-1-yl]-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000044 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(trans-2-aminocyclohexyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000046 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(trans-2-aminocyclohexyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000048 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-methylsulfanyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000049 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(2-hydroxyethyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.00005 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(piperazin-1-yl)-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000051 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(3-amino-2-hydroxypropyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000054 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5(R)-[1-(hydroxymethyl)propyl]amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000061 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(thiomorpholinyl)-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000062 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | (2R)-2-{[9-(propan-2-yl)-6-({[4-(pyridin-2-yl)phenyl]methyl}amino)-9H-purin-2-yl]amino}butan-1-ol | |
| 0.00007 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-methylsulfonyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000096 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(trans-4-aminocyclohexyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000114 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(thiomorpholinyl)-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000119 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(piperazin-1-yl)-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000132 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-[4-(2-hydroxyethyl)piperazin-1-yl]-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000158 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | roscovitine | |
| 0.000165 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-methylsulfonyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000179 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(trans-4-aminocyclohexyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000183 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000197 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000225 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | (2R)-2-{[9-(propan-2-yl)-6-({[4-(pyridin-2-yl)phenyl]methyl}amino)-9H-purin-2-yl]amino}butan-1-ol | |
| 0.000229 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-methylsulfanyl-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000422 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-[4-(2-hydroxyethyl)piperazin-1-yl]-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.000467 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-[2-(dimethylamino)ethyl]amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.001069 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | roscovitine | |
| 0.00145 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5,7-di[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.001486 | - |
isoform CDK2, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(4-methoxybenzyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.002136 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-[2-(dimethylamino)ethyl]amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.0036 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5,7-di[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
| 0.004415 | - |
isoform CDK5, at pH 7.5, temperature not specified in the publication | Homo sapiens | 3-isopropyl-5-(4-methoxybenzyl)amino-7-[4-(2-pyridyl)benzyl]amino-1(2)H-pyrazolo[4,3-d]pyrimidine | |
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