Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.69 |
| ▸ | RAB9A | P51151 | 4/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.69 |
| ▸ | CASP3 | P42574 | 1/20 | 0.69 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.69 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.69 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.69 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.56 |
| ▸ | PYGL | P06737 | 1/20 | 0.53 |
| ▸ | FADS1 | O60427 | 3/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.50 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11743614 | 0.93 | NPC1 (0.72) | NPC1RAB9AKDM4EHSD17B10CASP3 | |
| SCHEMBL392793 | 0.87 | NPC1 (0.70) | NPC1RAB9AKDM4EHSD17B10CASP3 | |
| SCHEMBL1702919 | 0.86 | NPC1 (0.74) | NPC1RAB9AKDM4EHSD17B10CASP3 | |
| SCHEMBL30489855 | 0.86 | NPC1 (0.74) | NPC1RAB9AKDM4EHSD17B10CASP3 | |
| Hydrochloric Acid SCHEMBL11743643 | 0.85 | NPC1 (0.68) | NPC1RAB9AKDM4EHSD17B10CASP3 | |
| SCHEMBL7717671 | 0.84 | NPC1 (0.72) | NPC1RAB9AKDM4EHSD17B10CASP3 | |
| SCHEMBL7722705 | 0.84 | NPC1 (0.72) | NPC1RAB9AKDM4EHSD17B10CASP3 | |
| SCHEMBL31462147 | 0.84 | NPC1 (0.68) | NPC1RAB9AKDM4EHSD17B10CASP3 | |
| SCHEMBL31606761 | 0.84 | NPC1 (0.68) | NPC1RAB9AKDM4EHSD17B10CASP3 | |
| SCHEMBL4642645 | 0.84 | NPC1 (0.68) | NPC1RAB9AKDM4EHSD17B10CASP3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008094909-A2 | QUINAZOLINONE AND FUSED PYRIMIDINONE COMPOUNDS AND THEIR USE IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS | XENON PHARMACEUTICALS INC. (CA) | 2008-08-07 | — | — | WO | disclosed |