Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | ERBB3 | P21860 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2076138 | 0.85 | HRH4 (0.54) | HRH4SMN1; SMN2ALDH1A1RAB9ALOXL2 | |
| SCHEMBL2074954 | 0.84 | HRH4 (0.55) | HRH4SMN1; SMN2ALDH1A1RAB9ANPC1 | |
| SCHEMBL2074480 | 0.84 | HRH4 (0.55) | HRH4SMN1; SMN2ALDH1A1RAB9ANPC1 | |
| SCHEMBL2074972 | 0.84 | HRH4 (0.55) | HRH4SMN1; SMN2ALDH1A1RAB9ANPC1 | |
| SCHEMBL2074889 | 0.84 | HRH4 (0.55) | HRH4SMN1; SMN2ALDH1A1RAB9ANPC1 | |
| SCHEMBL2075259 | 0.84 | HRH4 (0.55) | HRH4SMN1; SMN2ALDH1A1RAB9ANPC1 | |
| SCHEMBL2075711 | 0.84 | HRH4 (0.53) | HRH4SMN1; SMN2ALDH1A1RAB9ANPC1 | |
| SCHEMBL2073149 | 0.83 | HRH4 (0.54) | HRH4SMN1; SMN2ALDH1A1RAB9ANPC1 | |
| SCHEMBL2074719 | 0.83 | HRH4 (0.54) | HRH4SMN1; SMN2ALDH1A1RAB9ANPC1 | |
| SCHEMBL2072405 | 0.83 | HRH4 (0.52) | HRH4SMN1; SMN2ALDH1A1RAB9ALOXL2 |
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-7902184-B2 | Piperazinyl pyrimidine derivatives | HOFFMANN-LA ROCHE INC. (US) | 2011-03-08 | — | — | US | disclosed |