Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | RAB9A | P51151 | 6/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MME | P08473 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | AHR | P35869 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2693858 | 0.88 | SMN1; SMN2 (0.43) | SMN1; SMN2NPC1RAB9AHTTATM | |
| SCHEMBL3364009 | 0.82 | MME (0.52) | SMN1; SMN2NPC1RAB9AHTTATM | |
| SCHEMBL28018732 | 0.78 | GRM5 (0.52) | SMN1; SMN2NPC1RAB9AHTTATM | |
| SCHEMBL4344801 | 0.78 | NPC1 (0.44) | SMN1; SMN2NPC1RAB9AHTTATM | |
| SCHEMBL7932473 | 0.77 | RAB9A (0.44) | SMN1; SMN2NPC1RAB9AHTTATM | |
| SCHEMBL19306197 | 0.76 | RAB9A (0.43) | SMN1; SMN2NPC1RAB9AHTTATM | |
| SCHEMBL28018731 | 0.76 | MME (0.47) | SMN1; SMN2NPC1RAB9AHTTATM | |
| SCHEMBL2694492 | 0.75 | METAP1 (0.42) | SMN1; SMN2RAB9ADHODHLMNANPSR1 | |
| SCHEMBL12775799 | 0.75 | ALDH1A1 (0.44) | SMN1; SMN2NPC1RAB9AHTTATM | |
| SCHEMBL17700420 | 0.74 | SMN1; SMN2 (0.34) | SMN1; SMN2NPC1RAB9AHTTATM |
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-3031799-B1 | AROMATIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2018-04-04 | — | — | EP | disclosed |
| EP-3031799-A1 | AROMATIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2016-06-15 | — | — | EP | disclosed |