Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | WDR5 | P61964 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | PLK1 | P53350 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL260602 | 0.83 | ALDH1A1 (0.51) | MAPTSMN1; SMN2GAAALDH1A1NPC1 | |
| SCHEMBL12582233 | 0.76 | RAB9A (0.48) | MAPTSMN1; SMN2ADORA3ALDH1A1NPC1 | |
| SCHEMBL14736254 | 0.76 | PDE10A (0.50) | MAPTSMN1; SMN2TP53GAAADORA3 | |
| SCHEMBL10099711 | 0.76 | PDE10A (0.54) | MAPTSMN1; SMN2TP53GAAADORA1 | |
| SCHEMBL2030331 | 0.75 | TLR8 (0.46) | MAPTSMN1; SMN2TP53GAAALDH1A1 | |
| SCHEMBL3298893 | 0.75 | NPC1 (0.75) | MAPTSMN1; SMN2TP53GAAADORA3 | |
| SCHEMBL14736793 | 0.75 | PDE10A (0.61) | MAPTSMN1; SMN2TP53GAAALDH1A1 | |
| SCHEMBL10099708 | 0.73 | MAPT (0.60) | MAPTSMN1; SMN2TP53ADORA3ADORA2B | |
| SCHEMBL259679 | 0.73 | PDE10A (0.54) | MAPTSMN1; SMN2TP53GAAADORA1 | |
| SCHEMBL20085562 | 0.73 | MAPT (0.41) | MAPTSMN1; SMN2TP53GAAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007006-A1 | TRIAZOLO- AND PYRAZOLOQUINAZOLINE DERIVATIVES AS PDE10A ENZYME INHIBITOR | H. LUNDBECK A/S (DK) | 2012-01-19 | — | — | WO | disclosed |