Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 7/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 7/20 | 0.36 |
| ▸ | F2R | P25116 | 1/20 | 0.36 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ADH1B | P00325 | 3/20 | 0.33 |
| ▸ | ADH1A | P07327 | 3/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.32 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.32 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.32 |
| ▸ | NMT1 | P30419 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 2/20 | 0.31 |
| ▸ | ADH7 | P40394 | 2/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
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 | 0.82 | ITGB3 (0.40) | ITGB3ITGA2BF2RALDH1A1NAMPT | |
| SCHEMBL5212565 | 0.81 | ADH1B (0.32) | ADH1BADH1AADH1CADH7 | |
| SCHEMBL7447186 | 0.79 | GNAO1 (0.43) | ITGB3ITGA2BF2RALDH1A1GNAI3 | |
| SCHEMBL7448756 | 0.77 | GNAO1 (0.38) | ITGB3ITGA2BF2RALDH1A1NAMPT | |
| SCHEMBL7454474 | 0.76 | ALDH1A1 (0.37) | ITGB3ITGA2BF2RALDH1A1GNAI3 | |
| SCHEMBL7446660 | 0.75 | ITGB3 (0.36) | ITGB3ITGA2BF2RSMYD3ALDH1A1 | |
| SCHEMBL7446777 | 0.75 | GNAO1 (0.40) | ITGB3ITGA2BF2RALDH1A1GNAI3 | |
| SCHEMBL7447634 | 0.74 | ITGB3 (0.36) | ITGB3ITGA2BF2RALDH1A1GNAI3 | |
| SCHEMBL7446739 | 0.74 | ITGB3 (0.40) | ITGB3ITGA2BF2RALDH1A1 | |
| SCHEMBL7455215 | 0.73 | GNAO1 (0.47) | ITGB3ITGA2BF2RGNAI3GNAO1 |
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 |