Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN7 | P35236 | 1/20 | 0.54 |
| ▸ | MRGPRX4 | Q96LA9 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | MAOB | P27338 | 6/20 | 0.50 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | STS | P08842 | 2/20 | 0.48 |
| ▸ | MAOA | P21397 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27361265 | 0.87 | PTPN7 (0.54) | PTPN7MRGPRX4NPC1RAB9AMAOB | |
| SCHEMBL31695369 | 0.87 | PTPN7 (0.54) | PTPN7MRGPRX4NPC1RAB9AMAOB | |
| SCHEMBL27361097 | 0.78 | MRGPRX4 (0.54) | MRGPRX4RAB9ASMN1; SMN2 | |
| SCHEMBL30694672 | 0.75 | PTPN7 (0.50) | PTPN7NPC1RAB9AMAOBKDM4E | |
| SCHEMBL27361240 | 0.74 | NPC1 (0.48) | NPC1RAB9AKDM4EALDH1A1GLA | |
| SCHEMBL30694638 | 0.72 | PTPN7 (0.51) | PTPN7MRGPRX4NPC1RAB9AMAOB | |
| SCHEMBL30694662 | 0.70 | STS (0.49) | PTPN7NPC1RAB9AMAOBSLC16A3 | |
| SCHEMBL27362897 | 0.70 | STS (0.49) | PTPN7NPC1RAB9AMAOBSLC16A3 | |
| SCHEMBL13486911 | 0.70 | NPC1 (0.74) | NPC1RAB9AMAOBSLC16A3KDM4E | |
| SCHEMBL22480680 | 0.69 | MRGPRX4 (1.00) | MRGPRX4RAB9ASMN1; SMN2 |
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-2023235753-A2 | ALDH2 INHIBITORS AND METHODS OF USE THEREOF | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2023-12-07 | — | — | WO | disclosed |