Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.48 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.47 |
| ▸ | NAMPT | P43490 | 3/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | PRKCI | P41743 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 7/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8589013 | 0.84 | MLYCD (0.45) | MLYCDNAMPTNPC1RAB9AKMT2A | |
| SCHEMBL8589012 | 0.84 | MLYCD (0.45) | MLYCDNAMPTNPC1RAB9AKMT2A | |
| SCHEMBL22500097 | 0.79 | MAPK1 (0.56) | BAZ2BMAOAMAOBPRKCIMAPK14 | |
| SCHEMBL22516823 | 0.79 | MAPK14 (0.49) | BAZ2BMAOAMAOBPRKCIMAPK14 | |
| SCHEMBL19029127 | 0.78 | BAZ2B (0.56) | BAZ2BMAOAMAOBPRKCIMAPK14 | |
| SCHEMBL29649324 | 0.78 | BAZ2B (0.56) | BAZ2BMAOAMAOBPRKCIMAPK14 | |
| SCHEMBL22500434 | 0.78 | MAPK1 (0.58) | BAZ2BMAOAMAOBPRKCIMAPK14 | |
| SCHEMBL22517131 | 0.78 | MAPK14 (0.48) | BAZ2BMAPK14NPC1RAB9A | |
| SCHEMBL8201692 | 0.76 | MLYCD (0.42) | MLYCDNAMPTMAPK14KMT2AS1PR1 | |
| SCHEMBL8198550 | 0.76 | MLYCD (0.46) | MLYCDNAMPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998036749-A1 | TETRALONE DERIVATIVES AS ANTIARRHYTHMIC AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-08-27 | — | — | WO | claimed |
| US-6048877-A | Tetralone derivatives as antiarrhythmic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 2000-04-11 | — | — | US | disclosed |
| WO-1998036749-A1 | TETRALONE DERIVATIVES AS ANTIARRHYTHMIC AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-08-27 | — | — | WO | disclosed |