Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.57 |
| ▸ | MEN1 | O00255 | 5/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | NAMPT | P43490 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL13702299 | 0.85 | CYP1A2 (0.65) | CYP1A2CYP3A4KDM4EKMT2AMEN1 | |
| SCHEMBL166939 | 0.84 | CYP1A2 (0.67) | CYP1A2CYP3A4KDM4EKMT2AMEN1 | |
| SCHEMBL166100 | 0.83 | MEN1 (0.64) | CYP1A2CYP3A4KDM4EKMT2AMEN1 | |
| SCHEMBL11722616 | 0.83 | KDM4E (0.67) | CYP1A2CYP3A4KDM4EKMT2AMEN1 | |
| SCHEMBL3644078 | 0.83 | CYP1A2 (0.65) | CYP1A2CYP3A4KDM4EKMT2AMEN1 | |
| SCHEMBL13701753 | 0.82 | CYP1A2 (0.61) | CYP1A2CYP3A4KDM4EKMT2AMEN1 | |
| SCHEMBL1573212 | 0.81 | CYP1A2 (0.67) | CYP1A2CYP3A4KDM4EKMT2AMEN1 | |
| SCHEMBL166484 | 0.80 | LMNA (0.82) | CYP1A2CYP3A4KDM4EKMT2AMEN1 | |
| SCHEMBL31396771 | 0.80 | CYP1A2 (0.65) | CYP1A2CYP3A4KDM4EKMT2AMEN1 | |
| SCHEMBL29818105 | 0.80 | CYP1A2 (0.65) | CYP1A2CYP3A4KDM4EKMT2AMEN1 |
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-2611441-A1 | BACE INHIBITORS FOR USE IN THE TREATMENT OF DIABETES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-07-10 | — | — | EP | disclosed |
| WO-2012028563-A1 | BACE INHIBITORS FOR USE IN THE TREATMENT OF DIABETES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-03-08 | — | — | WO | disclosed |