Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.44 |
| ▸ | PROKR1 | Q8TCW9 | 4/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.42 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.42 |
| ▸ | UBE2T | Q9NPD8 | 1/20 | 0.41 |
| ▸ | CTSA | P10619 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.39 |
| ▸ | WNT1 | P04628 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4397754 | 0.85 | PIK3CA (0.43) | PIK3CAPROKR1CTSAPRMT5ALDH1A1 | |
| SCHEMBL4411361 | 0.85 | PIK3CA (0.63) | PIK3CAPRMT5DYRK1AWNT1GSK3B | |
| SCHEMBL30505327 | 0.76 | PIK3CA (0.72) | HRH4PIK3CAPROKR1PRKD3PRKD1 | |
| SCHEMBL1255519 | 0.76 | PIK3CA (0.72) | HRH4PIK3CAPROKR1PRKD3PRKD1 | |
| SCHEMBL27991055 | 0.76 | PIK3CA (0.58) | HRH4PIK3CAPROKR1PRKD3PRKD1 | |
| SCHEMBL15891156 | 0.75 | UBE2T (0.67) | UBE2TSMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL12640115 | 0.75 | PIK3CA (0.54) | HRH4PIK3CAPROKR1PRKD3PRKD1 | |
| SCHEMBL30290310 | 0.75 | PRKD3 (0.62) | HRH4PIK3CAPROKR1PRKD3PRKD1 | |
| SCHEMBL3750019 | 0.75 | HRH3 (0.57) | HRH4PIK3CAPROKR1PRKD3PRKD1 | |
| SCHEMBL31143236 | 0.74 | PIK3CA (0.74) | PIK3CAPROKR1PRKD3PRKD1PRKD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1959951-B1 | HETEROARYL SUBSTITUTED PIPERIDINE DERIVATIVES AS L-CPT1 INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-12-23 | — | — | EP | disclosed |