Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.39 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.38 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.38 |
| ▸ | SQOR | Q9Y6N5 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20718126 | 0.82 | ALDH1A1 (0.50) | KDM4EALDH1A1IMPDH2IMPDH1MAPT | |
| SCHEMBL4958710 | 0.77 | KDM4E (0.61) | KDM4EALDH1A1MAPK1SMN1; SMN2IMPDH2 | |
| SCHEMBL28415690 | 0.77 | ALDH1A1 (0.41) | KDM4EALDH1A1MAPK1MAPTMEN1 | |
| SCHEMBL31171419 | 0.77 | KDM4E (0.61) | KDM4EALDH1A1MAPK1SMN1; SMN2IMPDH2 | |
| SCHEMBL28864503 | 0.72 | ALDH1A1 (0.48) | KDM4EALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL28313759 | 0.70 | KDM4E (0.64) | KDM4EALDH1A1MAPK1SMN1; SMN2IMPDH2 | |
| SCHEMBL28858809 | 0.68 | ALDH1A1 (0.43) | KDM4EALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL6736896 | 0.67 | POLB (0.47) | KDM4EALDH1A1MAPK1SMN1; SMN2IMPDH2 | |
| SCHEMBL4739158 | 0.67 | RAB9A (0.59) | KDM4EALDH1A1MAPK1SMN1; SMN2IMPDH2 | |
| SCHEMBL25017593 | 0.67 | NQO1 (0.50) | KDM4EALDH1A1MAPK1MAPTMEN1 |
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-108658993-B | Pyreneimide derivative and synthesis method and application thereof | 兰州大学 | 2020-07-10 | — | — | CN | disclosed |