Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.36 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL363897 | 0.85 | AR (0.36) | NR1H2NR1H3KCNN4KIF11MEN1 | |
| SCHEMBL363687 | 0.83 | POLB (0.36) | NR1H2NR1H3TBXA2RPDE2AMEN1 | |
| SCHEMBL10538155 | 0.74 | KIF11 (0.46) | KCNN4KIF11MEN1KMT2ACYP1A2 | |
| SCHEMBL3523419 | 0.74 | KCNN4 (0.58) | KCNN4KMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL364627 | 0.73 | NPC1 (0.35) | KCNN4MEN1KMT2ANPC1RAB9A | |
| SCHEMBL365534 | 0.73 | NPC1 (0.35) | KCNN4MEN1KMT2ANPC1RAB9A | |
| SCHEMBL363274 | 0.73 | NPC1 (0.35) | KCNN4MEN1KMT2ANPC1RAB9A | |
| SCHEMBL11563715 | 0.70 | HDAC3 (0.53) | KIF11MEN1KMT2ANPC1CYP1A2 | |
| SCHEMBL364097 | 0.69 | TRPA1 (0.35) | — | |
| SCHEMBL365185 | 0.68 | KIF11 (0.30) | KIF11 |
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 |