Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.58 |
| ▸ | NPC1 | O15118 | 6/20 | 0.58 |
| ▸ | RAB9A | P51151 | 6/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.58 |
| ▸ | HPGD | P15428 | 3/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | BACE1 | P56817 | 2/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 3/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.47 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3511276 | 0.86 | HTR7 (0.57) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL16328113 | 0.85 | KDM4E (0.56) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL13033551 | 0.84 | NPC1 (0.54) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL13033512 | 0.83 | ACHE (0.76) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL13033499 | 0.81 | KDM4E (0.55) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL3511121 | 0.81 | DRD2 (0.58) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL13033489 | 0.81 | ACHE (0.56) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL13033508 | 0.80 | ACHE (0.58) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL13033513 | 0.80 | ACHE (0.56) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL13033498 | 0.78 | LMNA (0.64) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E |
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-1210340-A1 | SUBSTITUTED PIPERAZINE DERIVATIVES, THE PRODUCTION THEREOF AND THEIR UTILIZATION AS MEDICAMENTS | Boehringer Ingelheim Pharma KG (DE) | 2002-06-05 | — | — | EP | disclosed |
| WO-2001014355-A1 | SUBSTITUTED PIPERAZINE DERIVATIVES, THE PRODUCTION THEREOF AND THEIR UTILIZATION AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-03-01 | — | — | WO | disclosed |