Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MECP2 | P51608 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.38 |
| ▸ | AXL | P30530 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29521739 | 1.00 | MAOA (0.50) | MAOAMAP4K4TRPA1BRD4PTPN5 | |
| SCHEMBL3398486 | 0.81 | SCN9A (0.53) | MAOAMAP4K4TRPA1 | |
| Ethane SCHEMBL28326570 | 0.80 | MAOA (0.62) | MAOAMAP4K4BRD4MAPTMEN1 | |
| SCHEMBL29471388 | 0.80 | MAOA (0.68) | MAOAMAP4K4BRD4MAPTMEN1 | |
| SCHEMBL2023695 | 0.80 | MAOA (0.68) | MAOAMAP4K4BRD4MAPTMEN1 | |
| SCHEMBL23105473 | 0.79 | TRPA1 (0.45) | TRPA1MAPTMEN1KDM4EALDH1A1 | |
| SCHEMBL9258898 | 0.78 | TRPA1 (0.45) | TRPA1PTPN5MEN1KMT2A | |
| SCHEMBL9261126 | 0.78 | TRPA1 (0.45) | TRPA1PTPN5MAPTKDM4ELMNA | |
| SCHEMBL8707495 | 0.78 | PTPN5 (0.48) | TRPA1PTPN5ALDH1A1LMNACYP3A4 | |
| SCHEMBL291792 | 0.78 | ALDH1A1 (0.46) | TRPA1PTPN5MEN1ALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109776335-B | Amine derivative of pyrene, preparation method, application and device thereof | 武汉尚赛光电科技有限公司 | 2022-03-18 | — | — | CN | disclosed |
| CN-108358795-B | Aromatic diamine monomer containing tert-butyl substituted meta-terphenyl structure and preparation method thereof | 常州大学 | 2020-03-20 | — | — | CN | disclosed |
| CN-109776335-A | Amine derivant of pyrene and preparation method thereof, application and device | 武汉尚赛光电科技有限公司 | 2019-05-21 | — | — | CN | disclosed |