Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.45 |
| ▸ | AKT2 | P31751 | 3/20 | 0.42 |
| ▸ | DKK1 | O94907 | 1/20 | 0.41 |
| ▸ | VCP | P55072 | 1/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | PAK4 | O96013 | 2/20 | 0.37 |
| ▸ | PAK1 | Q13153 | 2/20 | 0.37 |
| ▸ | KIT | P10721 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21590373 | 0.81 | HRH3 (0.53) | HRH3HRH4AKT2DKK1VCP | |
| SCHEMBL1634508 | 0.80 | CHKA (0.52) | HRH4MEN1ALOX15KMT2A | |
| SCHEMBL30900615 | 0.80 | CHKA (0.52) | HRH4MEN1ALOX15KMT2A | |
| SCHEMBL25247515 | 0.80 | HRH4 (0.47) | HRH4 | |
| SCHEMBL7008838 | 0.80 | HRH4 (0.48) | HRH3HRH4AKT2DKK1KIT | |
| SCHEMBL2272239 | 0.80 | HTR3E (0.47) | HRH3HRH4AKT2DKK1VCP | |
| SCHEMBL29132185 | 0.80 | HRH4 (0.35) | HRH4CDK1CDK2 | |
| SCHEMBL16684915 | 0.80 | SMARCA2 (0.47) | HRH3HRH4 | |
| SCHEMBL31341814 | 0.79 | HRH4 (0.54) | HRH4MEN1ALOX15KMT2A | |
| SCHEMBL5314278 | 0.79 | HRH4 (0.54) | HRH4MEN1ALOX15KMT2A |
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-2012069852-A1 | PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF SPHINGOSINE KINASE | ALMAC DISCOVERY LIMITED (GB) | 2012-05-31 | — | — | WO | disclosed |