Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 2/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.35 |
| ▸ | OXTR | P30559 | 3/20 | 0.35 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.35 |
| ▸ | IDH1 | O75874 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.32 |
| ▸ | MAP3K5 | Q99683 | 2/20 | 0.31 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | CTSD | P07339 | 1/20 | 0.31 |
| ▸ | CTSE | P14091 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2340822 | 0.90 | DDB1 (0.37) | DDB1CRBNOXTRAVPR1AIDH1 | |
| SCHEMBL2336887 | 0.89 | PDE4B (0.36) | DDB1CRBNOXTRAVPR1AESR2 | |
| SCHEMBL2341708 | 0.89 | DDB1 (0.34) | DDB1CRBNOXTRAVPR1AESR2 | |
| SCHEMBL2340272 | 0.89 | DDB1 (0.35) | DDB1CRBNOXTRAVPR1AESR2 | |
| SCHEMBL2336519 | 0.89 | DDB1 (0.35) | DDB1CRBNOXTRAVPR1AESR2 | |
| SCHEMBL2469674 | 0.87 | PDE4A (0.34) | DDB1CRBNOXTRAVPR1AESR2 | |
| SCHEMBL2550063 | 0.86 | NAMPT (0.40) | DDB1CRBNOXTRAVPR1AESR2 | |
| SCHEMBL2469541 | 0.85 | GPR119 (0.34) | DDB1CRBNOXTRAVPR1AESR2 | |
| SCHEMBL2573980 | 0.85 | DDB1 (0.38) | DDB1CRBNOXTRAVPR1AESR2 | |
| SCHEMBL2579657 | 0.85 | OXTR (0.36) | DDB1CRBNOXTRAVPR1AESR2 |
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-2358714-A1 | ALKYLCYCLOHEXYLETHERS OF DIHYDROTETRAAZABENZOAZULENES | F. Hoffmann-La Roche AG (CH) | 2011-08-24 | — | — | EP | claimed |
| WO-2010057795-A1 | ALKYLCYCLOHEXYLETHERS OF DIHYDROTETRAAZABENZOAZULENES | F. HOFFMANN-LA ROCHE AG (CH) | 2010-05-27 | — | — | WO | claimed |
| EP-2358714-A1 | ALKYLCYCLOHEXYLETHERS OF DIHYDROTETRAAZABENZOAZULENES | F. Hoffmann-La Roche AG (CH) | 2011-08-24 | — | — | EP | disclosed |
| WO-2010057795-A1 | ALKYLCYCLOHEXYLETHERS OF DIHYDROTETRAAZABENZOAZULENES | F. HOFFMANN-LA ROCHE AG (CH) | 2010-05-27 | — | — | WO | disclosed |