Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 12/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20576697 | 0.87 | ADORA2A (0.53) | LMNAADORA2AADORA3ADORA2BADORA1 | |
| SCHEMBL28042323 | 0.76 | PDE10A (0.49) | ADORA2AADORA3ADORA2BADORA1TDO2 | |
| SCHEMBL15903915 | 0.75 | ADORA2A (0.76) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL18414192 | 0.72 | TDO2 (0.53) | LMNAADORA2AADORA3ADORA2BADORA1 | |
| SCHEMBL2546094 | 0.72 | ADORA2A (0.76) | ADORA2AADORA3ADORA2BADORA1PDE10A | |
| SCHEMBL27992037 | 0.72 | ADORA2A (0.60) | LMNAADORA2AADORA3ADORA2BADORA1 | |
| SCHEMBL27992067 | 0.70 | ADORA2A (0.46) | LMNAADORA2AADORA3ADORA2BADORA1 | |
| SCHEMBL27992032 | 0.70 | ADORA2A (0.58) | ADORA2AADORA3ADORA2BADORA1TDO2 | |
| SCHEMBL27992040 | 0.69 | ADORA2A (0.37) | LMNAADORA2AADORA3ADORA2BADORA1 | |
| SCHEMBL27992012 | 0.69 | ADORA2A (0.48) | ADORA2AADORA3ADORA2BADORA1TDO2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105008346-A | Novel pyrimidine derivatives as phosphodiesterase 10(PDE-10) inhibitors | PALOBIOFARMA SL | 2015-10-28 | — | — | CN | claimed |
| CN-105008346-A | Novel pyrimidine derivatives as phosphodiesterase 10(PDE-10) inhibitors | PALOBIOFARMA SL | 2015-10-28 | — | — | CN | disclosed |