Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | PRKCI | P41743 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | BAD | Q92934 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30047627 | 1.00 | MAOA (0.37) | MAOAMAOBPRKCITAAR1DYRK1A | |
| SCHEMBL30305680 | 0.82 | BCL2L1 (0.45) | MAOAMAOBPRKCIDYRK1AESR2 | |
| SCHEMBL2264771 | 0.78 | AR (0.37) | KDM4EGAAMAPTDRD2DRD4 | |
| SCHEMBL4644733 | 0.77 | MAOA (0.33) | MAOAMAOBMEN1KMT2AGRIN2D | |
| SCHEMBL3675894 | 0.77 | BCL2L1 (0.50) | MAOAMAOBPRKCIDYRK1AESR1 | |
| SCHEMBL12490226 | 0.74 | MAPT (0.34) | MEN1KMT2AALDH1A1MAPTGRIN2D | |
| SCHEMBL22618608 | 0.74 | MAOA (0.37) | MAOAMAOBPRKCIBCL2L1BAD | |
| SCHEMBL22618607 | 0.74 | MAOA (0.37) | MAOAMAOBPRKCIBCL2L1BAD | |
| SCHEMBL8436954 | 0.74 | BCL2L1 (0.42) | BCL2L1BADCA12CA1CA9 | |
| SCHEMBL30686151 | 0.74 | MAPT (0.34) | MEN1KMT2AALDH1A1MAPTGRIN2D |
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-115298176-A | Compounds and their use in the treatment of bacterial infections | 豪夫迈·罗氏有限公司 | 2022-11-04 | — | — | CN | disclosed |