Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MGAM | O43451 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SI | P14410 | 1/20 | 0.46 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7896414 | 0.88 | HRH3 (0.39) | NPC1RAB9AKDM4EHRH3CA12 | |
| SCHEMBL7903966 | 0.87 | NPC1 (0.47) | NPC1RAB9AKDM4EMGAMGAA | |
| SCHEMBL7904727 | 0.85 | GAA (0.50) | NPC1RAB9AKDM4EMGAMGAA | |
| SCHEMBL7896418 | 0.81 | RAB9A (0.46) | NPC1RAB9AKDM4EMGAMGAA | |
| SCHEMBL7905953 | 0.79 | RAB9A (0.45) | NPC1RAB9AKDM4EHRH3LMNA | |
| Hydrochloric Acid SCHEMBL7908541 | 0.78 | RAB9A (0.44) | NPC1RAB9AKDM4EHRH3LMNA | |
| SCHEMBL7896426 | 0.76 | MAPK1 (0.42) | NPC1RAB9AMGAMGAASI | |
| Hydrochloric Acid SCHEMBL7904720 | 0.75 | RAB9A (0.36) | NPC1RAB9AKDM4EMGAMGAA | |
| SCHEMBL7902307 | 0.74 | RAB9A (0.40) | NPC1RAB9AKDM4EMGAMGAA | |
| SCHEMBL7904033 | 0.74 | CA12 (0.37) | NPC1RAB9AKDM4ECA12CA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6191152-B1 | CARDIOVASCULAR DISORDERS, NERVOUS SYSTEM DISORDERS | EGIS GYÓGYSZERGYAR RT. (HU) | 2001-02-20 | — | — | US | disclosed |