Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5249068 | 0.91 | KDM4E (0.64) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB | |
| SCHEMBL30003417 | 0.87 | KDM4E (0.74) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB | |
| SCHEMBL14349080 | 0.87 | KDM4E (0.74) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB | |
| SCHEMBL30660758 | 0.85 | KDM4E (0.79) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB | |
| SCHEMBL755681 | 0.85 | KDM4E (0.79) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB | |
| SCHEMBL22788818 | 0.83 | KDM4E (0.67) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB | |
| SCHEMBL757747 | 0.82 | KDM4E (0.82) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB | |
| SCHEMBL8859782 | 0.82 | ALDH1A1 (0.82) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB | |
| SCHEMBL9629450 | 0.80 | KDM4E (0.56) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB | |
| SCHEMBL52405 | 0.79 | ALDH1A1 (1.00) | KDM4EALDH1A1SMN1; SMN2MAPK1POLB |
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-109790129-B | Pyrene triazine derivative and application thereof in organic electronic device | 广州华睿光电材料有限公司 | 2022-08-12 | — | — | CN | disclosed |