Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | GCGR | P47871 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.37 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | STK10 | O94804 | 1/20 | 0.36 |
| ▸ | SLK | Q9H2G2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5887155 | 0.90 | NOTUM (0.36) | GSK3BMAPK14SMN1; SMN2 | |
| SCHEMBL6047660 | 0.89 | ALDH1A1 (0.40) | GSK3BDYRK1ACLK4ALDH1A1SMN1; SMN2 | |
| SCHEMBL5887285 | 0.88 | ALKBH3 (0.44) | MAOBDYRK1ACLK4KDM4EALDH1A1 | |
| SCHEMBL5887199 | 0.87 | KMT2A (0.35) | ALDH1A3CNR1ALDH1A1SMN1; SMN2GPBAR1 | |
| SCHEMBL6416879 | 0.85 | HPGD (0.32) | — | |
| SCHEMBL6047606 | 0.83 | NR1I3 (0.39) | MAPK14MAOBSMN1; SMN2 | |
| SCHEMBL5887303 | 0.82 | CASR (0.39) | GSK3BMAOBSMN1; SMN2NFE2L2 | |
| SCHEMBL5887105 | 0.82 | ESR2 (0.35) | GSK3BSMN1; SMN2 | |
| SCHEMBL6047579 | 0.80 | GRIA1 (0.31) | — | |
| SCHEMBL5887143 | 0.80 | PTGS2 (0.35) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7037931-B2 | Corticotropin releasing factor moderator; analgesics; drug abruse, drug dependency; schizophrenia | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-05-02 | — | — | US | claimed |