Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL26873124 | 0.92 | TEAD2 (0.40) | ALDH1A1NPC1RAB9AKDM4EHSD17B10 | |
| Hydrochloric Acid SCHEMBL26686919 | 0.91 | TEAD2 (0.39) | ALDH1A1NPC1RAB9AKDM4EHSD17B10 | |
| SCHEMBL24687912 | 0.83 | ALDH1A1 (0.41) | ALDH1A1NPC1RAB9AKDM4EHSD17B10 | |
| SCHEMBL26686907 | 0.80 | ALDH1A1 (0.38) | ALDH1A1NPC1RAB9AKDM4EHSD17B10 | |
| SCHEMBL30685681 | 0.80 | ALDH1A1 (0.39) | ALDH1A1NPC1RAB9AKDM4EHSD17B10 | |
| Hydrochloric Acid SCHEMBL26686999 | 0.79 | ALDH1A1 (0.37) | ALDH1A1NPC1RAB9AKDM4EHSD17B10 | |
| SCHEMBL30685698 | 0.76 | KDM4E (0.39) | ALDH1A1NPC1RAB9AKDM4EHPGD | |
| SCHEMBL26686903 | 0.75 | KDM4E (0.42) | KDM4EHPGDADORA3ADORA2AGAA | |
| SCHEMBL31667548 | 0.72 | POLB (0.50) | ALDH1A1NPC1RAB9AKDM4EHPGD | |
| SCHEMBL28555287 | 0.72 | MAPT (0.49) | ALDH1A1NPC1RAB9AKDM4EGAA |
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-117279917-A | Piperazine derivatives and their use in medicine | 成都百裕制药股份有限公司 | 2023-12-22 | — | — | CN | disclosed |