Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 7/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 5/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.33 |
| ▸ | DYRK1B | Q9Y463 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | DYRK2 | Q92630 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 2/20 | 0.33 |
| ▸ | NOS2 | P35228 | 2/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29960501 | 0.89 | MAP3K14 (0.36) | MAP3K14MAOBMAOACES1DYRK1A | |
| SCHEMBL23116793 | 0.79 | — | — | |
| SCHEMBL20561610 | 0.78 | ITGB2 (0.41) | MAP3K14CES1DYRK1ADYRK1BALDH1A1 | |
| SCHEMBL21584043 | 0.72 | FABP6 (0.45) | MAP3K14CES1DYRK1ADYRK1BALDH1A1 | |
| SCHEMBL2044224 | 0.72 | — | — | |
| SCHEMBL9587538 | 0.68 | CES1 (0.35) | CES1LMNATSHRNOS3NOS2 | |
| SCHEMBL4196242 | 0.68 | MAP3K14 (0.48) | MAP3K14CES1DYRK1ADYRK1BALDH1A1 | |
| SCHEMBL20741821 | 0.67 | MAOA (0.36) | MAOBMAOAGRM5ALDH1A1LMNA | |
| SCHEMBL350515 | 0.66 | — | — | |
| SCHEMBL9149481 | 0.64 | ALDH1A1 (0.45) | MAOBALDH1A1LMNANPC1HPGD |
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-2009020578-A1 | ALPHA2C ADRENORECEPTOR AGONISTS | SCHERING CORPORATION (US) | 2009-02-12 | — | — | WO | disclosed |