Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | ALDH1A3 | P47895 | 5/20 | 0.40 |
| ▸ | ALDH1A2 | O94788 | 3/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.37 |
| ▸ | TUBB | P07437 | 1/20 | 0.37 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.37 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.37 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.37 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.37 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.37 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5248164 | 0.84 | DHODH (0.36) | ALDH1A1ALDH1A3ALDH1A2DHODHKDM4E | |
| SCHEMBL5250303 | 0.84 | DHODH (0.38) | ALDH1A1ALDH1A3ALDH1A2DHODHKDM4E | |
| SCHEMBL5248531 | 0.82 | MAPT (0.61) | ALDH1A1KDM4ERAB9ANPC1MAPT | |
| SCHEMBL5073373 | 0.81 | DHODH (0.50) | ALDH1A1ALDH1A3ALDH1A2DHODHKDM4E | |
| SCHEMBL5252624 | 0.81 | DHODH (0.59) | ALDH1A1ALDH1A3ALDH1A2DHODHKDM4E | |
| SCHEMBL5253083 | 0.79 | DHODH (0.64) | ALDH1A1ALDH1A3ALDH1A2DHODHKDM4E | |
| SCHEMBL5252652 | 0.79 | DHODH (0.47) | ALDH1A1ALDH1A3ALDH1A2DHODHKDM4E | |
| SCHEMBL5250307 | 0.79 | DHODH (0.39) | ALDH1A1ALDH1A3ALDH1A2CASP1DHODH | |
| SCHEMBL5251228 | 0.79 | DHODH (0.53) | ALDH1A1ALDH1A3ALDH1A2DHODHKDM4E | |
| SCHEMBL5254537 | 0.78 | DHODH (0.40) | ALDH1A1ALDH1A3ALDH1A2DHODHKDM4E |
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-1257551-B1 | HETEROCYCLIC COMPOUNDS AND THEIR USE AS PARP INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2007-09-05 | — | — | EP | disclosed |