Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7014186 | 0.72 | FAAH (0.42) | FAAHKCNH2 | |
| SCHEMBL14573150 | 0.67 | KCNH2 (0.51) | KCNH2 | |
| SCHEMBL6669040 | 0.67 | KCNH2 (0.45) | KCNH2 | |
| SCHEMBL6667354 | 0.66 | KCNH2 (0.44) | KCNH2 | |
| SCHEMBL5774252 | 0.66 | KCNH2 (0.40) | FAAHKCNH2 | |
| SCHEMBL5774764 | 0.65 | FAAH (0.60) | FAAHKCNH2HTR1ADRD4 | |
| SCHEMBL5764918 | 0.65 | KCNH2 (0.45) | KCNH2 | |
| SCHEMBL5660329 | 0.62 | L3MBTL1 (0.50) | FAAHHTR1A | |
| SCHEMBL6666166 | 0.62 | KCNH2 (0.39) | KCNH2HTR1A | |
| SCHEMBL5255843 | 0.60 | NNMT (0.42) | GRM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1343780-A1 | PIPERAZINE DERIVATIVES FOR TREATMENT OF BACTERIAL INFECTIONS | SMITHKLINE BEECHAM PLC (GB) | 2003-09-17 | — | — | EP | claimed |
| WO-2002050061-A1 | PIPERAZINE DERIVATIVES FOR TREATMENT OF BACTERIAL INFECTIONS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-06-27 | — | — | WO | claimed |