Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | GCGR | P47871 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.35 |
| ▸ | PRKCI | P41743 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL16890776 | 0.97 | NOTUM (0.43) | NOTUMDYRK1AMKNK1PIK3CAMAPK13 | |
| SCHEMBL16890915 | 0.97 | NOTUM (0.43) | NOTUMDYRK1AMKNK1PIK3CAMAPK13 | |
| SCHEMBL16889621 | 0.96 | NOTUM (0.42) | NOTUMDYRK1AMKNK1PIK3CAMAPK13 | |
| SCHEMBL16889513 | 0.93 | DYRK1A (0.38) | NOTUMDYRK1AMKNK1PIK3CAMAPT | |
| SCHEMBL16889366 | 0.93 | DYRK1A (0.38) | NOTUMDYRK1AMKNK1PIK3CAMAPT | |
| SCHEMBL16889432 | 0.89 | MAOA (0.34) | MAPTCYP3A4 | |
| SCHEMBL16889577 | 0.88 | NOTUM (0.40) | NOTUMDYRK1AMKNK1PIK3CAMAPK13 | |
| SCHEMBL19845790 | 0.87 | MEN1 (0.32) | MAPT | |
| SCHEMBL16890927 | 0.86 | NOTUM (0.43) | NOTUMDYRK1AMKNK1PIK3CAMAPK13 | |
| SCHEMBL16889820 | 0.86 | CA12 (0.33) | MAPT |
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-3345911-A1 | POLYCYCLIC AROMATIC COMPOUNDS AND THEIR USE AS ORGANIC DEVICE MATERIAL | Kwansei Gakuin Educational Foundation (JP) | 2018-07-11 | — | — | EP | disclosed |
| WO-2015102118-A1 | POLYCYCLIC AROMATIC COMPOUND | 学校法人関西学院 | 2015-07-09 | — | — | WO | disclosed |