Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.49 |
| ▸ | MAOB | P27338 | 4/20 | 0.49 |
| ▸ | CES2 | O00748 | 4/20 | 0.46 |
| ▸ | TNF | P01375 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 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 | |
|---|---|---|---|---|
| SCHEMBL7767777 | 1.00 | MAOA (0.49) | MAOAMAOBCES2TNFCA1 | |
| SCHEMBL12819448 | 0.85 | PARP1 (0.46) | MAOAMAOBCA1CA2CA7 | |
| SCHEMBL12965293 | 0.85 | PARP1 (0.46) | MAOAMAOBCA1CA2CA7 | |
| SCHEMBL7767503 | 0.79 | METAP1 (0.57) | MAOAMAOBCES2TNFCA1 | |
| SCHEMBL7767505 | 0.79 | METAP1 (0.57) | MAOAMAOBCES2TNFCA1 | |
| SCHEMBL26073771 | 0.76 | BCHE (0.52) | MAOAMAOBCA1CA2CA7 | |
| SCHEMBL4808970 | 0.76 | MIF (0.61) | MAOAMAOBCES2ACHE | |
| SCHEMBL4808965 | 0.76 | MIF (0.61) | MAOAMAOBCES2ACHE | |
| SCHEMBL21801661 | 0.75 | CES2 (0.46) | MAOAMAOBCES2LCK | |
| SCHEMBL11428273 | 0.74 | MIF (0.62) | MAOAMAOBTNF |
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-0700905-B1 | Tricyclic pyrazole derivatives | HOFFMANN LA ROCHE (CH) | 2001-10-31 | — | — | EP | disclosed |
| US-5561150-A | 1-AMINOALKYL-1,4-DIHYDROINDENO(2,1-C)PYRAZOLES OR 1H-BENZ(G)INDAZOLES; SEROTONIN RECEPTOR ANTAGONISTS; ANTIDEPRESSANTS; NERVOUS SYSTEM, PSYCHOLOGICAL AND GASTROINTESTINAL DISORDERS | HOFFMAN-LA ROCHE INC. (US) | 1996-10-01 | — | — | US | disclosed |
| EP-0700905-A1 | Tricyclic pyrazole derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1996-03-13 | — | — | EP | disclosed |