CHEMGRID MOLECULE CARD
BENZBROMARONE
BENZBROMARONE in ChemGrid: 13 screened assays, 13 with significant responses. Explore chemical identifiers, strain activity and target evidence.
SPE01505971
Explore activity & SONAR
Identity and chemistry
- ChemGrid identifier
- SPE01505971
- Molecular formula
- Br2C17H12O3
- CAS registry number
- 117976-90-6
- InChIKey
- WHQCHUCQKNIQEC-UHFFFAOYSA-N
- Libraries
- Spectrum_ED
- Other recorded names
- Benzbromarone
Stored SMILES
CCc1oc2ccccc2c1C(=O)c1cc(Br)c(O)c(Br)c1Matched external records: PubChem 2333
Chemical identifiers and library names are reproduced from ChemGrid records. Missing values are omitted.
Measured chemical–genetic activity
13 measurements across 13 distinct library–species–strain assays; 13 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 |
|---|---|---|---|
| BY4741-3rd | Spectrum_ED | 4932 | -57.05 |
| BY4741-2nd | Spectrum_ED | 4932 | -50.42 |
| BCK1 | Spectrum_ED | 4932 | -30.77 |
| pdr_yCG196 | Spectrum_ED | 4932 | -29.72 |
| TOR1 | Spectrum_ED | 4932 | -29.07 |
| NPR1 | Spectrum_ED | 4932 | -28.19 |
| MKK1 | Spectrum_ED | 4932 | -25.56 |
| SLT2 | Spectrum_ED | 4932 | -24.83 |
| IRE1 | Spectrum_ED | 4932 | -24.41 |
| HOG1 | Spectrum_ED | 4932 | -24.14 |
| BY4741 | Spectrum_ED | 4932 | -20.58 |
| CLN2 | Spectrum_ED | 4932 | -20.25 |
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 |
|---|---|---|
| ABCC1 · Multidrug resistance-associated protein 1 | ChEMBL | No stored yeast mapping |
| ABCG2 · Broad substrate specificity ATP-binding cassette transporter ABCG2 | ChEMBL | SNQ2 YDR011W (ortholog_many2many); PDR15 YDR406W (ortholog_many2many); PDR11 YIL013C (ortholog_many2many); YNR070W (ortholog_many2many); AUS1 YOR011W (ortholog_many2many); PDR5 YOR153W (ortholog_many2many); PDR10 YOR328W (ortholog_many2many); PDR12 YPL058C (ortholog_many2many) |
| AKR1C1 · Aldo-keto reductase family 1 member C1 | 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) |
| CHRM2 · Muscarinic acetylcholine receptor M2 | ChEMBL | No stored yeast mapping |
| CYP2C9 · Cytochrome P450 2C9 | ChEMBL | No stored yeast mapping |
| LMNA · Prelamin-A/C | ChEMBL | No stored yeast mapping |
| NS1 · Nonstructural protein 1 | ChEMBL | No stored yeast mapping |
| PPARG · Peroxisome proliferator-activated receptor gamma | ChEMBL | No stored yeast mapping |
| SLC22A12 · Solute carrier family 22 member 12 | ChEMBL | PHO84 YML123C (ortholog_one2many) |
| TTR · Transthyretin | ChEMBL | No stored yeast mapping |
| USP2 · Ubiquitin carboxyl-terminal hydrolase 2 | ChEMBL | UBP13 YBL067C (ortholog_many2many); UBP9 YER098W (ortholog_many2many) |
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 BENZBROMARONE 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.