Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.33 |
| ▸ | MAOA | P21397 | 4/20 | 0.33 |
| ▸ | MAOB | P27338 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29038339 | 0.86 | CA1 (0.35) | CA12CA1CA2CA3CA6 | |
| SCHEMBL29038336 | 0.84 | CA1 (0.34) | MAPTCA12CA1CA2CA3 | |
| SCHEMBL8410542 | 0.84 | ALDH1A1 (0.31) | KDM1AMAOAMAOB | |
| SCHEMBL1153469 | 0.75 | KDM1A (0.44) | KDM1AMAOAMAOB | |
| SCHEMBL3992251 | 0.73 | KDM1A (0.36) | KDM1AMAOAMAOB | |
| SCHEMBL734440 | 0.71 | KDM1A (0.38) | KDM1AMAOAMAOB | |
| SCHEMBL11266183 | 0.70 | KDM1A (0.34) | KDM1AMAOAMAOB | |
| SCHEMBL20017698 | 0.70 | HTR2A (0.35) | KDM1AMAOAMAOB | |
| SCHEMBL13818654 | 0.70 | KDM1A (0.34) | KDM1AMAOAMAOB | |
| SCHEMBL505429 | 0.69 | EDNRA (0.32) | KDM4EMAPTHPGDCA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116283672-B | Synthesis method and application of beta-allyl phenethylamine derivative | 四川师范大学 | 2024-09-17 | — | — | CN | disclosed |
| CN-116283672-A | Synthesis method and application of beta-allyl phenethylamine derivative | 四川师范大学 | 2023-06-23 | — | — | CN | disclosed |