Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SLC29A1 | Q99808 | 9/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | PDE4A | P27815 | 3/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.35 |
| ▸ | RGS12 | O14924 | 1/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 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 | |
|---|---|---|---|---|
| SCHEMBL9937267 | 0.88 | HTR2C (0.44) | HTR2CNPC1SLC29A1SMN1; SMN2KDM4E | |
| SCHEMBL4248606 | 0.72 | HTR2C (0.43) | HTR2CNPC1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL5315250 | 0.68 | ALDH1A1 (0.46) | SLC29A1ALDH1A1PDE4APDE4BPDE4C | |
| SCHEMBL7930957 | 0.66 | ALDH1A1 (0.44) | SLC29A1ALDH1A1PDE4APDE4BPDE4C | |
| SCHEMBL7942147 | 0.65 | HTT (0.45) | NPC1PKMSLC29A1ALDH1A1PDE4A | |
| SCHEMBL1284337 | 0.65 | PIK3CA (0.46) | HTR2CNPC1ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL5055246 | 0.64 | SLC29A1 (0.43) | SLC29A1ALDH1A1PDE4APDE4BPDE4C | |
| SCHEMBL5055250 | 0.64 | SLC29A1 (0.83) | SLC29A1ALDH1A1PDE4APDE4BPDE4C | |
| SCHEMBL4439753 | 0.64 | HTR2C (0.45) | HTR2CNPC1SMN1; SMN2KDM4E | |
| SCHEMBL29973070 | 0.64 | SLC29A1 (0.83) | SLC29A1ALDH1A1PDE4APDE4BPDE4C |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3053925-A1 | TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | F. Hoffmann-La Roche AG (CH) | 2016-08-10 | — | — | EP | disclosed |