Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.39 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL2075518 | 0.99 | HRH4 (0.52) | HRH4SMN1; SMN2L3MBTL1EPHX2TP53 | |
| SCHEMBL2076172 | 0.92 | HRH4 (0.52) | HRH4SMN1; SMN2TP53ALDH1A1RAB9A | |
| SCHEMBL2075594 | 0.91 | HRH4 (0.53) | HRH4SMN1; SMN2TP53ALDH1A1RAB9A | |
| SCHEMBL2074120 | 0.89 | HRH4 (0.48) | HRH4SMN1; SMN2TP53ALDH1A1RAB9A | |
| SCHEMBL2074130 | 0.89 | HRH4 (0.53) | HRH4SMN1; SMN2ALDH1A1RAB9AP4HTM | |
| SCHEMBL2076138 | 0.88 | HRH4 (0.54) | HRH4SMN1; SMN2ALDH1A1RAB9AP4HTM | |
| SCHEMBL2073169 | 0.88 | HRH4 (0.50) | HRH4SMN1; SMN2TP53ALDH1A1RAB9A | |
| SCHEMBL2075478 | 0.88 | HRH4 (0.54) | HRH4SMN1; SMN2ALDH1A1RAB9AP4HTM | |
| SCHEMBL2074954 | 0.87 | HRH4 (0.55) | HRH4SMN1; SMN2ALDH1A1RAB9AP4HTM | |
| SCHEMBL2074889 | 0.87 | HRH4 (0.55) | HRH4SMN1; SMN2ALDH1A1RAB9AP4HTM |
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 2 patents. 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 | claimed |
| US-7902184-B2 | Piperazinyl pyrimidine derivatives | HOFFMANN-LA ROCHE INC. (US) | 2011-03-08 | — | — | US | disclosed |