Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8767202 | 0.89 | CTNNB1 (0.47) | THRATHRBHPGDKDM4EMAPT | |
| SCHEMBL28383737 | 0.85 | THRA (0.49) | THRATHRBHPGDKDM4EMAPT | |
| SCHEMBL13125267 | 0.85 | MRGPRX4 (0.54) | THRATHRBHPGDKDM4ESMN1; SMN2 | |
| SCHEMBL13125206 | 0.84 | MAPT (0.53) | HPGDKDM4EMAPTALDH1A1L3MBTL1 | |
| SCHEMBL6136939 | 0.83 | TAS1R3 (0.53) | MAPTALDH1A1SMN1; SMN2LMNANPC1 | |
| SCHEMBL28458940 | 0.79 | MAPT (0.43) | THRATHRBHPGDKDM4EMAPT | |
| SCHEMBL10543265 | 0.78 | S1PR4 (0.56) | THRATHRBMAPTALDH1A1L3MBTL1 | |
| SCHEMBL19815794 | 0.78 | KDM4E (0.56) | THRATHRBHPGDKDM4EMAPT | |
| SCHEMBL29525037 | 0.78 | KDM4E (0.56) | THRATHRBHPGDKDM4EMAPT | |
| SCHEMBL29840609 | 0.78 | KDM4E (0.50) | THRATHRBHPGDKDM4EMAPT |
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-111004107-B | Substituted dichlorobenzene compound containing propenone, preparation method and application | 山东大学 | 2021-03-16 | — | — | CN | disclosed |
| CN-111004107-A | Substituted dichlorobenzene compound containing propenone, preparation method and application | 山东大学 | 2020-04-14 | — | — | CN | disclosed |
| CN-109748785-A | Two aromatic hydrocarbon substituted propenone class compounds of one kind and preparation method and application | 山东大学 | 2019-05-14 | — | — | CN | disclosed |