Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 11/20 | 0.58 |
| ▸ | TNKS2 | Q9H2K2 | 11/20 | 0.58 |
| ▸ | PARP1 | P09874 | 7/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | PDE5A | O76074 | 1/20 | 0.48 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.48 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5438893 | 0.75 | TNKS (0.65) | TNKSTNKS2PARP1NPC1RAB9A | |
| SCHEMBL258433 | 0.74 | TNKS (1.00) | TNKSTNKS2PARP1NPC1RAB9A | |
| SCHEMBL29592833 | 0.74 | TNKS (1.00) | TNKSTNKS2PARP1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL31529601 | 0.73 | TNKS (0.96) | TNKSTNKS2PARP1NPC1RAB9A | |
| SCHEMBL2617083 | 0.73 | TNKS (0.77) | TNKSTNKS2PARP1NPC1RAB9A | |
| SCHEMBL23905219 | 0.71 | NPC1 (0.82) | TNKSTNKS2PARP1NPC1RAB9A | |
| SCHEMBL6124189 | 0.71 | TNKS (0.93) | TNKSTNKS2PARP1NPC1RAB9A | |
| SCHEMBL14281548 | 0.70 | PARP1 (0.46) | TNKS2PARP1NPC1RAB9AADORA3 | |
| SCHEMBL19236511 | 0.70 | MITF (0.47) | ALDH1A1MAPTALOX15HSD17B10MEN1 | |
| SCHEMBL6885282 | 0.70 | TNKS (0.93) | TNKSTNKS2PARP1NPC1RAB9A |
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-1673355-A1 | SUBSTITUTED TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS | Pfizer Limited (GB) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005028452-A1 | SUBSTITUTED TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS | PFIZER LIMITED (GB) | 2005-03-31 | — | — | WO | disclosed |