Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.65 |
| ▸ | MAOA | P21397 | 4/20 | 0.65 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | CFTR | P13569 | 1/20 | 0.50 |
| ▸ | PRKCI | P41743 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1351091 | 0.83 | NPC1 (0.54) | MAOBMAOANPC1RAB9AMAPT | |
| SCHEMBL4107604 | 0.81 | BRAF (0.61) | MAOBMAOAHDAC8BCAT2 | |
| SCHEMBL15875737 | 0.79 | MAOB (1.00) | MAOBMAOANPC1RAB9AMAPT | |
| SCHEMBL1354136 | 0.78 | HDAC8 (0.74) | NPC1HDAC8BCAT2 | |
| SCHEMBL170646 | 0.76 | F2 (0.68) | MAOBMAOANPC1RAB9AMAPT | |
| SCHEMBL27522161 | 0.76 | F2 (0.68) | MAOBMAOANPC1RAB9AMAPT | |
| SCHEMBL29540009 | 0.76 | F2 (0.68) | MAOBMAOANPC1RAB9AMAPT | |
| SCHEMBL4716837 | 0.76 | MAOB (0.71) | MAOBMAOANPC1RAB9AMAPT | |
| SCHEMBL30026512 | 0.74 | NPC1 (0.63) | MAOBMAOANPC1RAB9AMAPT | |
| SCHEMBL1576877 | 0.74 | NPC1 (0.63) | MAOBMAOANPC1RAB9AMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2064213-A1 | HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2009-06-03 | — | — | EP | claimed |
| WO-2008028617-A1 | HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-03-13 | — | — | WO | claimed |
| EP-2064213-A1 | HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2009-06-03 | — | — | EP | disclosed |
| WO-2008028617-A1 | HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-03-13 | — | — | WO | disclosed |