Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.36 |
| ▸ | CYP3A5 | P20815 | 5/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.35 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.31 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.31 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.31 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.31 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.31 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.31 |
| ▸ | CCR9 | P51686 | 1/20 | 0.31 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL362323 | 0.89 | KCNN4 (0.41) | HDAC3HDAC1HDAC2HDAC6KMO | |
| SCHEMBL363084 | 0.89 | SORT1 (0.34) | PROKR1MAPK1SORT1ALDH1A1KCNH2 | |
| SCHEMBL364587 | 0.89 | SORT1 (0.34) | PROKR1MAPK1SORT1ALDH1A1KCNH2 | |
| SCHEMBL362712 | 0.89 | SORT1 (0.34) | PROKR1MAPK1SORT1ALDH1A1KCNH2 | |
| SCHEMBL364151 | 0.87 | CYP3A4 (0.35) | HDAC3HDAC1HDAC2HDAC6CYP3A4 | |
| SCHEMBL364096 | 0.87 | CYP3A4 (0.35) | HDAC3HDAC1HDAC2HDAC6CYP3A4 | |
| SCHEMBL364634 | 0.79 | PROKR1 (0.35) | PROKR1MAPK1SORT1KCNH2PSEN1 | |
| SCHEMBL364536 | 0.79 | SORT1 (0.35) | CYP3A4KMOSORT1ALDH1A1PSEN1 | |
| SCHEMBL363549 | 0.78 | NPC1 (0.34) | CYP3A4MAPK1SORT1ALDH1A1 | |
| SCHEMBL364193 | 0.78 | NPC1 (0.34) | CYP3A4MAPK1SORT1ALDH1A1 |
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-2593426-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | disclosed |