CHEMGRID MOLECULE CARD
7-CHLOROETHYLTHEOPHYLLINE
7-CHLOROETHYLTHEOPHYLLINE in ChemGrid: 101 screened assays, 0 with significant responses. Explore chemical identifiers, strain activity and target evidence.
SPE02300318
Explore activity & SONAR
Identity and chemistry
- ChemGrid identifier
- SPE02300318
- Molecular formula
- C9ClH11N4O2
- InChIKey
- QCIARNIKNKKHFH-UHFFFAOYSA-N
- Libraries
- Spectrum
- Other recorded names
- 7-(2-Chloroethyl)theophylline
Stored SMILES
CN1C(=O)N(C)c2ncn(CCCl)c2C1=OMatched external records: PubChem 1882
Chemical identifiers and library names are reproduced from ChemGrid records. Missing values are omitted.
Measured chemical–genetic activity
101 measurements across 101 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 |
|---|---|---|
| Adora1 · Adenosine receptor A1 | ChEMBL | No stored yeast mapping |
| ADORA2A · Adenosine receptor A2a | ChEMBL | No stored yeast mapping |
| Adora2b · Adenosine receptor A2b | ChEMBL | No stored yeast mapping |
| GNAS · Guanine nucleotide-binding protein G(s) subunit alpha isoforms short | ChEMBL | GPA2 YER020W (ortholog_many2many); GPA1 YHR005C (ortholog_many2many) |
| MAPT · Microtubule-associated protein tau | ChEMBL | No stored yeast mapping |
| POLI · DNA polymerase iota | ChEMBL | 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 7-CHLOROETHYLTHEOPHYLLINE 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.