CHEMGRID MOLECULE CARD
4,6-dimethyl-2-[(4-methylphenyl)thio]-5-nitronicotinonitrile
4,6-dimethyl-2-[(4-methylphenyl)thio]-5-nitronicotinonitrile in ChemGrid: 50 screened assays, 11 with significant responses. Explore chemical identifiers, strain activity and target evidence.
RF 00661
Explore activity & SONAR![Chemical structure of 4,6-dimethyl-2-[(4-methylphenyl)thio]-5-nitronicotinonitrile](/structure-thumbnails/Maybridge1000/RF/RF_00661.svg?v=2026-09-22T13%3A54%3A31%2B00%3A00)
Identity and chemistry
- ChemGrid identifier
- RF 00661
- Molecular formula
- C15H13N3O2S
- InChIKey
- PSBJAWHNHWIELO-UHFFFAOYSA-N
- Libraries
- Maybridge1000
- Other recorded names
- 4,6-Dimethyl-2-[(4-methylphenyl)thio]-5-nitronicotinonitrile
Stored SMILES
[O-][N+](=O)c1c(C)nc(Sc2ccc(C)cc2)c(C#N)c1CMatched external records: PubChem 2726173
Chemical identifiers and library names are reproduced from ChemGrid records. Missing values are omitted.
Measured chemical–genetic activity
50 measurements across 50 distinct library–species–strain assays; 11 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.
| Strain | Library | Species identifier | Z-score |
|---|---|---|---|
| MT2481-Fenbendazole | Maybridge1000 | 4932 | -10.59 |
| MT2481-Camptothecin | Maybridge1000 | 4932 | -10.35 |
| But24 | Maybridge1000 | 4932 | -7.13 |
| CHRA24 | Maybridge1000 | 4932 | -6.95 |
| ric1 | Maybridge1000 | 4932 | -6.43 |
| MT2481-pdr1pdr3 | Maybridge1000 | 4932 | -5.90 |
| ypt6 | Maybridge1000 | 4932 | -5.83 |
| MT2481-Cantharidin | Maybridge1000 | 4932 | -5.36 |
| slt2 | Maybridge1000 | 4932 | -4.81 |
| But18 | Maybridge1000 | 4932 | -4.28 |
| Peu18 | Maybridge1000 | 4932 | -4.21 |
Spectrum compound-combination identifiers are excluded from this short table. The interactive profile retains the full measurements.
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 |
|---|---|---|
| ATXN2 · Ataxin-2 | ChEMBL | No stored yeast mapping |
| EHMT2 · Histone-lysine N-methyltransferase EHMT2 | ChEMBL | SET2 YJL168C (ortholog_many2many) |
| GMNN · Geminin | ChEMBL | No stored yeast mapping |
| KAT2A · Histone acetyltransferase KAT2A | ChEMBL | BDF2 YDL070W (ortholog_many2many); BDF1 YLR399C (ortholog_many2many) |
| KDM4A · Lysine-specific demethylase 4A | ChEMBL | YJR119C (ortholog_one2many) |
| NFE2L2 · Nuclear factor erythroid 2-related factor 2 | ChEMBL | No stored yeast mapping |
| RAPGEF4 · Rap guanine nucleotide exchange factor 4 | ChEMBL | LTE1 YAL024C (ortholog_many2many) |
| SMAD3 · Mothers against decapentaplegic homolog 3 | ChEMBL | No stored yeast mapping |
| TDP1 · Tyrosyl-DNA phosphodiesterase 1 | ChEMBL | TDP1 YBR223C (ortholog_one2one) |
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 4,6-dimethyl-2-[(4-methylphenyl)thio]-5-nitronicotinonitrile 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.