Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 8/20 | 0.45 |
| ▸ | MELK | Q14680 | 3/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | FLT1 | P17948 | 1/20 | 0.31 |
| ▸ | FLT4 | P35916 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28042324 | 0.84 | PDE10A (0.59) | PDE10A | |
| SCHEMBL15905011 | 0.78 | PDE10A (0.74) | PDE10AADORA2A | |
| SCHEMBL28246191 | 0.77 | MELK (0.40) | PDE10AMELKADORA3ADORA1CYP3A4 | |
| SCHEMBL15904208 | 0.74 | PDE10A (0.50) | PDE10AMELKADORA3ADORA1ADORA2A | |
| SCHEMBL28042559 | 0.71 | PDE10A (0.58) | PDE10AADORA1ADORA2A | |
| SCHEMBL2550404 | 0.71 | ADORA2A (0.53) | PDE10AADORA3ADORA1ADORA2A | |
| SCHEMBL28042347 | 0.70 | EGLN1 (0.45) | PDE10AADORA2AEGLN1 | |
| SCHEMBL15904189 | 0.69 | PDE10A (0.72) | PDE10AADORA3ADORA1ADORA2A | |
| SCHEMBL28042545 | 0.68 | PDE10A (0.68) | PDE10AADORA2A | |
| SCHEMBL28042323 | 0.68 | PDE10A (0.49) | PDE10AMELKADORA3ADORA1ADORA2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105008346-B | Pyrimidine derivatives as phosphodiesterase 10(PDE-10) inhibitors | 帕罗生物制药有限公司 | 2018-11-13 | — | — | CN | claimed |
| CN-105008346-A | Novel pyrimidine derivatives as phosphodiesterase 10(PDE-10) inhibitors | PALOBIOFARMA SL | 2015-10-28 | — | — | CN | claimed |
| CN-105008346-B | Pyrimidine derivatives as phosphodiesterase 10(PDE-10) inhibitors | 帕罗生物制药有限公司 | 2018-11-13 | — | — | CN | disclosed |
| CN-105008346-A | Novel pyrimidine derivatives as phosphodiesterase 10(PDE-10) inhibitors | PALOBIOFARMA SL | 2015-10-28 | — | — | CN | disclosed |