Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 7/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1607526 | 0.89 | MAOB (0.48) | MAOBLMNAMAPK1CYP1A2CYP2D6 | |
| SCHEMBL4737237 | 0.85 | TP53 (0.45) | MAOBLMNAMAPK1MTNR1AMTNR1B | |
| SCHEMBL30114007 | 0.83 | MAOB (0.58) | MAOBLMNAMAPK1MTNR1AMTNR1B | |
| SCHEMBL2047854 | 0.83 | MAOB (0.58) | MAOBLMNAMAPK1MTNR1AMTNR1B | |
| SCHEMBL5642762 | 0.80 | MAOB (0.53) | MAOB | |
| SCHEMBL30114274 | 0.80 | MAOB (0.53) | MAOB | |
| SCHEMBL2186305 | 0.80 | MAOB (0.42) | MAOBLMNAMAPK1CYP1A2CYP2D6 | |
| SCHEMBL3720039 | 0.79 | PIM1 (0.43) | MAOB | |
| SCHEMBL30639570 | 0.79 | PIM1 (0.43) | MAOB | |
| SCHEMBL761063 | 0.78 | ACHE (0.59) | MAOBLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1919875-A2 | PYRAZOLE DERIVATIVES AND THEIR USE AS PKA AND PKB MODULATORS | Astex Therapeutics Limited (GB) | 2008-05-14 | — | — | EP | disclosed |
| WO-2006136829-A2 | PYRAZOLE DERIVATIVES AND THEIR USE AS PKA AND PKB MODULATORS | ASTEX THERAPEUTICS LIMITED (GB) | 2006-12-28 | — | — | WO | disclosed |