Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.38 |
| ▸ | PAK4 | O96013 | 2/20 | 0.36 |
| ▸ | PAK1 | Q13153 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.34 |
| ▸ | PRPS1 | P60891 | 1/20 | 0.34 |
| ▸ | GNRHR | P30968 | 1/20 | 0.33 |
| ▸ | CDC7 | O00311 | 2/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.33 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17009227 | 1.00 | HCRTR1 (0.42) | HCRTR1HRH4PAK4PAK1CHRNA3 | |
| SCHEMBL15174141 | 0.79 | HCRTR1 (0.39) | HCRTR1CHRNA3 | |
| SCHEMBL16277337 | 0.79 | HCRTR1 (0.39) | HCRTR1CHRNA3 | |
| SCHEMBL2578413 | 0.73 | HRH4 (0.55) | HRH4PAK4PAK1GNRHRCDC7 | |
| SCHEMBL22761650 | 0.73 | HCRTR1 (0.39) | HCRTR1HRH3 | |
| SCHEMBL17009213 | 0.71 | PRPS1 (0.36) | HCRTR1PRPS1CDK1CDK2 | |
| SCHEMBL16277755 | 0.68 | HCRTR1 (0.47) | HCRTR1 | |
| SCHEMBL18734332 | 0.68 | HCRTR1 (0.47) | HCRTR1 | |
| SCHEMBL16284061 | 0.67 | HCRTR1 (0.33) | HCRTR1IRAK4HRH3 | |
| SCHEMBL1519442 | 0.66 | LMNA (0.47) | HRH4 |
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-2015123355-A1 | SUBSTITUTED PROLINES / PIPERIDINES AS OREXIN RECEPTOR ANTAGONISTS | EOLAS THERAPEUTICS, INC. (US) | 2015-08-20 | — | — | WO | disclosed |