CHEMGRID MOLECULE CARD
Roscovitine
Roscovitine in ChemGrid: 24 screened assays, 0 with significant responses. Explore chemical identifiers, strain activity and target evidence.
LOPAC 01191
Explore activity & SONAR
Identity and chemistry
- ChemGrid identifier
- LOPAC 01191
- Molecular formula
- C19H26N6O
- InChIKey
- BTIHMVBBUGXLCJ-UHFFFAOYSA-N
- Libraries
- Lopac
- Other recorded names
- 2-(1-Ethyl-2-hydroxyethylamino)-6-benzylamino-9-isopropylpurine
Stored SMILES
CCC(CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1Matched external records: PubChem 5097
Chemical identifiers and library names are reproduced from ChemGrid records. Missing values are omitted.
Measured chemical–genetic activity
24 measurements across 24 distinct library–species–strain assays; 0 assays have at least one significant response (|Z| ≥ 4, p ≤ 0.001, excluding flagged outliers).
Responses are indirect screening phenotypes. They do not establish that a strain gene is a direct molecular target. Strains and timepoints are retained as recorded; these counts are not counts of unique ORFs.
Recorded target evidence and yeast matches
Source annotations are shown separately from SONAR hypotheses. Evidence type and identity matching can vary; consult the linked source and interactive evidence panel.
| Target | Source | Yeast ORF / orthologue |
|---|---|---|
| AKR1C3 · Aldo-keto reductase family 1 member C3 | ChEMBL | AAD3 YCR107W (ortholog_many2many); YDL124W (ortholog_many2many); AAD4 YDL243C (ortholog_many2many); YPR1 YDR368W (ortholog_many2many); AAD10 YJR155W (ortholog_many2many); YMR041C (ortholog_many2many); AAD14 YNL331C (ortholog_many2many); AAD15 YOL165C (ortholog_many2many); GCY1 YOR120W (ortholog_many2many) |
| CDK1 · Cyclin-dependent kinase 1 | ChEMBL | CDC28 YBR160W (ortholog_one2many) |
| CDK2 · Cyclin-dependent kinase 2 | ChEMBL | No stored yeast mapping |
| CDK5 · Cyclin-dependent kinase 5 | ChEMBL | No stored yeast mapping |
| CDK7 · Cyclin-dependent kinase 7 | ChEMBL | No stored yeast mapping |
| CDK9 · Cyclin-dependent kinase 9 | ChEMBL | SGV1 YPR161C (ortholog_one2one) |
| CLK2 · Dual specificity protein kinase CLK2 | ChEMBL | No stored yeast mapping |
| CLK4 · Dual specificity protein kinase CLK4 | ChEMBL | YAK1 YJL141C (ortholog_many2many); KNS1 YLL019C (ortholog_many2many) |
| CSNK1D · Casein kinase I isoform delta | ChEMBL | YCK3 YER123W (ortholog_many2many); YCK1 YHR135C (ortholog_many2many); YCK2 YNL154C (ortholog_many2many) |
| CSNK1G2 · Casein kinase I isoform gamma-2 | ChEMBL | YCK3 YER123W (ortholog_many2many); YCK1 YHR135C (ortholog_many2many); YCK2 YNL154C (ortholog_many2many) |
| DYRK1A · Dual specificity tyrosine-phosphorylation-regulated kinase 1A | ChEMBL | No stored yeast mapping |
| HIPK4 · Homeodomain-interacting protein kinase 4 | ChEMBL | KNS1 YLL019C (ortholog_many2many) |
| AKR1C3 · Aldo-keto reductase family 1 member C3 | ChEMBL analogue | AAD3 YCR107W (ortholog_many2many); YDL124W (ortholog_many2many); AAD4 YDL243C (ortholog_many2many); YPR1 YDR368W (ortholog_many2many); AAD10 YJR155W (ortholog_many2many); YMR041C (ortholog_many2many); AAD14 YNL331C (ortholog_many2many); AAD15 YOL165C (ortholog_many2many); GCY1 YOR120W (ortholog_many2many) |
| CDK1 · Cyclin-dependent kinase 1 | ChEMBL analogue | CDC28 YBR160W (ortholog_one2many) |
| CDK2 · Cyclin-dependent kinase 2 | ChEMBL analogue | No stored yeast mapping |
| CDK5 · Cyclin-dependent kinase 5 | ChEMBL analogue | No stored yeast mapping |
| CDK7 · Cyclin-dependent kinase 7 | ChEMBL analogue | No stored yeast mapping |
| CDK9 · Cyclin-dependent kinase 9 | ChEMBL analogue | SGV1 YPR161C (ortholog_one2one) |
| CLK2 · Dual specificity protein kinase CLK2 | ChEMBL analogue | No stored yeast mapping |
| CLK4 · Dual specificity protein kinase CLK4 | ChEMBL analogue | YAK1 YJL141C (ortholog_many2many); KNS1 YLL019C (ortholog_many2many) |
| CSNK1D · Casein kinase I isoform delta | ChEMBL analogue | YCK3 YER123W (ortholog_many2many); YCK1 YHR135C (ortholog_many2many); YCK2 YNL154C (ortholog_many2many) |
| CSNK1G2 · Casein kinase I isoform gamma-2 | ChEMBL analogue | YCK3 YER123W (ortholog_many2many); YCK1 YHR135C (ortholog_many2many); YCK2 YNL154C (ortholog_many2many) |
| CYP2D6 · Cytochrome P450 2D6 | ChEMBL analogue | No stored yeast mapping |
| DYRK1A · Dual specificity tyrosine-phosphorylation-regulated kinase 1A | ChEMBL analogue | No stored yeast mapping |
| HIPK4 · Homeodomain-interacting protein kinase 4 | ChEMBL analogue | KNS1 YLL019C (ortholog_many2many) |
| SMN1 · Survival motor neuron protein | ChEMBL analogue | No stored yeast mapping |
| TDP1 · Tyrosyl-DNA phosphodiesterase 1 | ChEMBL analogue | TDP1 YBR223C (ortholog_one2one) |
| CDK | ChemGrid bioactivity_info | No stored yeast mapping |
Structural activity predictions and SONAR
Stored structural activity predictions are available in the interactive profile, with assay-specific cutoffs and applicability-domain assessments.
SONAR ranks candidate targets through genetic and physical interaction evidence. Structural SONAR uses predicted strain responses; measured SONAR uses experimental responses. These are experimental hypotheses, not confirmed binding targets. Outside-domain predictions are treated as unknown.
Open the complete Roscovitine research profile →Sources and provenance
Screening measurements: ChemGrid chemical-genetic datasets. Wildenhain et al., Cell Systems (2015). Target annotations: sources named in the evidence table. Structure and library metadata: stored ChemGrid catalogue records.
Card snapshot: 2026-11-02. Linked interactive views may contain newer data.