Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SLC6A1 | P30531 | 1/20 | 0.39 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.39 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.39 |
| ▸ | SLC6A13 | Q9NSD5 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 4/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
| ▸ | HTR7 | P34969 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5592286 | 0.85 | MEN1 (0.50) | ALDH1A1SLC6A1SLC6A12SLC6A11SLC6A13 | |
| Hydrochloric Acid SCHEMBL5592275 | 0.84 | MEN1 (0.49) | ALDH1A1SLC6A1SLC6A12SLC6A11SLC6A13 | |
| SCHEMBL5592253 | 0.83 | HTR1A (0.46) | ALDH1A1SLC6A1SLC6A12SLC6A11SLC6A13 | |
| Hydrochloric Acid SCHEMBL5592288 | 0.82 | HTR1A (0.45) | ALDH1A1SLC6A1SLC6A12SLC6A11SLC6A13 | |
| SCHEMBL5330447 | 0.82 | SLC6A1 (0.60) | USP2HSD17B10ALDH1A1SLC6A1SLC6A12 | |
| SCHEMBL5810111 | 0.78 | KDM1A (0.51) | DRD2DRD3HTR1ACHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL5805233 | 0.78 | KDM1A (0.50) | DRD2DRD3HTR1ACHRM2CHRM1 | |
| SCHEMBL6240084 | 0.73 | DRD2 (0.71) | HSD17B10ALDH1A1DRD2DRD3HTR1A | |
| Hydrochloric Acid SCHEMBL5818499 | 0.73 | KMT2A (0.46) | HSD17B10ALDH1A1MEN1CYP3A4KMT2A | |
| Hydrochloric Acid SCHEMBL7105041 | 0.72 | DRD2 (0.70) | HSD17B10ALDH1A1DRD2DRD3HTR1A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007029156-A2 | ISOINDOLEDIONE DERIVATIVES AS ADRENERGIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2007-03-15 | — | — | WO | claimed |
| WO-2007029156-A2 | ISOINDOLEDIONE DERIVATIVES AS ADRENERGIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2007-03-15 | — | — | WO | disclosed |