Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 3/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | ESRRG | P62508 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2554543 | 0.87 | MAOA (0.53) | MAOAMAOBCES2CES1GSK3B | |
| SCHEMBL809720 | 0.83 | MAOA (0.50) | MAOAMAOBCES2CES1GSK3B | |
| SCHEMBL2011999 | 0.82 | MAOA (0.48) | MAOAMAOBL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL809973 | 0.82 | MAOA (0.48) | MAOAMAOBCES2CES1GSK3B | |
| SCHEMBL29209640 | 0.79 | MAOA (0.40) | MAOAMAOBCES2CES1GSK3B | |
| SCHEMBL28972199 | 0.79 | KMT2A (0.38) | CES2CES1GSK3BATMALDH1A1 | |
| SCHEMBL9000500 | 0.78 | MAOA (0.47) | MAOAMAOBL3MBTL1MAPK1ALDH1A1 | |
| SCHEMBL10673423 | 0.78 | MAOA (0.57) | MAOAMAOBCES2CES1GSK3B | |
| SCHEMBL8585794 | 0.77 | ALDH1A1 (0.46) | MAOAMAOBCES2CES1GSK3B | |
| SCHEMBL10415925 | 0.77 | MAOA (0.52) | MAOAMAOBCES2CES1GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0089100-B1 | AZOLYL DERIVATIVES AS FUNGICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-05-31 | — | — | EP | disclosed |
| US-4518415-A | PLANT GROWTH REGULATORS, FUNGICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1985-05-21 | — | — | US | disclosed |
| EP-0089100-A2 | Azolyl derivatives as fungicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-09-21 | — | — | EP | disclosed |