Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | ADRB3 | P13945 | 8/20 | 0.56 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.56 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9799340 | 0.89 | ALDH1A1 (0.56) | KDM4EL3MBTL1ADRB3ADRB1ALDH1A1 | |
| SCHEMBL8976776 | 0.87 | KDM4E (0.77) | KDM4EL3MBTL1ALDH1A1NPC1RAB9A | |
| SCHEMBL9061582 | 0.87 | KDM4E (0.77) | KDM4EL3MBTL1ALDH1A1NPC1RAB9A | |
| SCHEMBL11459271 | 0.87 | ADRB3 (0.53) | KDM4EL3MBTL1ADRB3ADRB1GRIA4 | |
| SCHEMBL10874048 | 0.81 | KDM4E (0.50) | KDM4EL3MBTL1ADRB3ADRB1ALDH1A1 | |
| SCHEMBL9241811 | 0.80 | KDM4E (0.51) | KDM4EL3MBTL1ADRB3ADRB1SMN1; SMN2 | |
| Acetic Acid SCHEMBL8948216 | 0.79 | KDM4E (0.80) | KDM4EL3MBTL1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL11357552 | 0.79 | ALDH1A1 (0.51) | KDM4EL3MBTL1ADRB3ADRB1ALDH1A1 | |
| SCHEMBL11369306 | 0.78 | ADRB3 (0.50) | KDM4EL3MBTL1ADRB3ADRB1ALDH1A1 | |
| SCHEMBL11373728 | 0.78 | MEN1 (0.53) | KDM4EL3MBTL1ADRB3ADRB1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0006735-A1 | Secondary amines, their preparation, pharmaceutical compositions containing them and their use | BEECHAM GROUP PLC (GB) | 1980-01-09 | — | — | EP | claimed |