Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.36 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.36 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 11/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 11/20 | 0.35 |
| ▸ | F2R | P25116 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 2/20 | 0.33 |
| ▸ | JAK1 | P23458 | 2/20 | 0.33 |
| ▸ | JAK3 | P52333 | 2/20 | 0.33 |
| ▸ | GNAO1 | P09471 | 2/20 | 0.33 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.33 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.33 |
| ▸ | NMT1 | P30419 | 1/20 | 0.32 |
| ▸ | ITGAV | P06756 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7450677 | 0.84 | ITGB3 (0.40) | ALDH1A1TPSAB1TPSD1TPSG1ITGB3 | |
| SCHEMBL7447186 | 0.83 | GNAO1 (0.43) | ALDH1A1ITGB3ITGA2BF2RGNAO1 | |
| SCHEMBL7448756 | 0.82 | GNAO1 (0.38) | ALDH1A1TPSAB1TPSD1TPSG1ITGB3 | |
| SCHEMBL7446777 | 0.80 | GNAO1 (0.40) | ALDH1A1ITGB3ITGA2BF2RHSD11B1 | |
| SCHEMBL7446660 | 0.80 | ITGB3 (0.36) | ALDH1A1TPSAB1TPSD1TPSG1ITGB3 | |
| SCHEMBL5216323 | 0.79 | NPC1 (0.32) | HSD11B1JAK2JAK1JAK3TYK2 | |
| SCHEMBL7447634 | 0.78 | ITGB3 (0.36) | ALDH1A1ITGB3ITGA2BF2RGNAO1 | |
| SCHEMBL7455215 | 0.77 | GNAO1 (0.47) | ITGB3ITGA2BF2RGNAO1GNAI3 | |
| SCHEMBL7447033 | 0.76 | ITGB3 (0.36) | ALDH1A1ITGB3ITGA2BF2RGNAO1 | |
| SCHEMBL7443444 | 0.76 | ITGB3 (0.35) | ALDH1A1ITGB3ITGA2BF2RGNAO1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1112270-A1 | DIHYDROBENZODIOXINE CARBOXAMIDE AND KETONE DERIVATIVES AS 5-HT4 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-07-04 | — | — | EP | disclosed |
| WO-2000015636-A1 | DIHYDROBENZODIOXINE CARBOXAMIDE AND KETONE DERIVATIVES AS 5-HT4 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2000-03-23 | — | — | WO | disclosed |