Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.31 |
| ▸ | PSEN1 | P49768 | 4/20 | 0.31 |
| ▸ | PSEN2 | P49810 | 4/20 | 0.31 |
| ▸ | APH1B | Q8WW43 | 4/20 | 0.31 |
| ▸ | NCSTN | Q92542 | 4/20 | 0.31 |
| ▸ | APH1A | Q96BI3 | 4/20 | 0.31 |
| ▸ | PSENEN | Q9NZ42 | 4/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 2/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL362479 | 0.90 | HDAC3 (0.30) | — | |
| SCHEMBL363954 | 0.81 | HDAC6 (0.32) | — | |
| SCHEMBL364445 | 0.80 | CYP3A4 (0.35) | CYP3A4MAPK1CYP3A5 | |
| SCHEMBL364596 | 0.77 | — | — | |
| SCHEMBL362569 | 0.76 | RORA (0.32) | SORT1GRM2 | |
| SCHEMBL364740 | 0.71 | KCNN4 (0.36) | CYP1A1CYP1B1CYP3A4SORT1PSEN1 | |
| SCHEMBL364334 | 0.71 | NR1H2 (0.41) | RXRAPSEN1PSEN2APH1BNCSTN | |
| SCHEMBL15949082 | 0.70 | — | — | |
| SCHEMBL364417 | 0.70 | — | — | |
| SCHEMBL363251 | 0.70 | KCNH2 (0.33) | — |
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 |