Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 8/20 | 0.49 |
| ▸ | GRM5 | P41594 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 3/20 | 0.47 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.44 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4780055 | 0.85 | PDE10A (0.50) | PDE4APDE4BPDE3BPDE3APDE10A | |
| SCHEMBL4780912 | 0.85 | PDE10A (0.47) | PRMT5WDR77ROCK2ROCK1PDE4A | |
| SCHEMBL4778874 | 0.84 | TP53 (0.46) | NPC1HPGDRAB9ASMN1; SMN2PDE4A | |
| SCHEMBL4781570 | 0.82 | PDE10A (0.36) | PRMT5WDR77ROCK2ROCK1PDE4A | |
| SCHEMBL4781215 | 0.79 | MAOA (0.39) | MAOBMAOAPRMT5WDR77ROCK2 | |
| SCHEMBL14303843 | 0.75 | ROCK2 (0.34) | ROCK2ROCK1 | |
| SCHEMBL24951298 | 0.71 | PDE10A (0.64) | PDE4APDE4BPDE3BPDE3APDE10A | |
| SCHEMBL4777045 | 0.69 | PDE4B (0.45) | MAOBNPSR1CYP11B1CYP11B2PDE4A | |
| SCHEMBL14310547 | 0.67 | PDE10A (0.51) | PDE4APDE4BPDE3BPDE3APDE10A | |
| SCHEMBL23905149 | 0.67 | MAOB (0.77) | MAOBGRM5NPC1ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008001182-A1 | TRICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS | PFIZER PRODUCTS INC. (US) | 2008-01-03 | — | — | WO | disclosed |
| WO-2008001182-A1 | TRICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS | PFIZER PRODUCTS INC. (US) | 2008-01-03 | — | — | WO | disclosed |