Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.68 |
| ▸ | RAB9A | P51151 | 5/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.68 |
| ▸ | MAPT | P10636 | 4/20 | 0.68 |
| ▸ | MEN1 | O00255 | 4/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.50 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.50 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.50 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.50 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.50 |
| ▸ | GRIA3 | P42263 | 2/20 | 0.50 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.50 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.50 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.50 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28473184 | 0.89 | NPC1 (0.69) | NPC1RAB9AKDM4EMAPTMEN1 | |
| SCHEMBL28463762 | 0.86 | NPC1 (0.55) | NPC1RAB9AKDM4EMAPTMEN1 | |
| SCHEMBL6311016 | 0.86 | NPC1 (0.66) | NPC1RAB9AKDM4EMAPTMEN1 | |
| SCHEMBL6311013 | 0.86 | NPC1 (0.66) | NPC1RAB9AKDM4EMAPTMEN1 | |
| SCHEMBL28470610 | 0.86 | NPC1 (0.55) | NPC1RAB9AKDM4EMAPTMEN1 | |
| SCHEMBL28899889 | 0.86 | NPC1 (0.52) | NPC1RAB9AKDM4EMAPTMEN1 | |
| SCHEMBL28470091 | 0.84 | RAB9A (0.53) | NPC1RAB9AKDM4EMAPTMEN1 | |
| SCHEMBL6307248 | 0.83 | KDM4E (0.68) | NPC1RAB9AKDM4EMAPTMEN1 | |
| SCHEMBL6307247 | 0.83 | KDM4E (0.68) | NPC1RAB9AKDM4EMAPTMEN1 | |
| SCHEMBL28464006 | 0.83 | NPC1 (0.52) | NPC1RAB9AKDM4EMAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111675665-A | Styryl-containing quinoxalinone derivatives and preparation method thereof | 南京大学 | 2020-09-18 | — | — | CN | disclosed |