Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | SLC29A1 | Q99808 | 4/20 | 0.47 |
| ▸ | NR2F2 | P24468 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13467264 | 0.88 | AURKA (0.46) | NPC1RAB9ASMN1; SMN2SLC29A1TSHR | |
| SCHEMBL12579985 | 0.87 | PAX8 (0.51) | NPC1RAB9ASMN1; SMN2SLC29A1CYP3A4 | |
| SCHEMBL13467417 | 0.86 | NR2F2 (0.57) | NPC1RAB9ASMN1; SMN2SLC29A1NR2F2 | |
| SCHEMBL9587879 | 0.85 | ADORA3 (0.46) | ALDH1A1ADORA3 | |
| SCHEMBL22866575 | 0.84 | NT5E (0.59) | NPC1RAB9ASMN1; SMN2SLC29A1NR2F2 | |
| Methyl Alcohol SCHEMBL9587418 | 0.84 | ADORA3 (0.46) | ALDH1A1ADORA3 | |
| SCHEMBL20626453 | 0.83 | SLC29A1 (0.52) | NPC1RAB9ASMN1; SMN2SLC29A1CYP3A4 | |
| SCHEMBL14714043 | 0.83 | SLC29A1 (0.52) | NPC1RAB9ASMN1; SMN2SLC29A1CYP3A4 | |
| SCHEMBL20626449 | 0.83 | SLC29A1 (0.52) | NPC1RAB9ASMN1; SMN2SLC29A1CYP3A4 | |
| SCHEMBL13467481 | 0.82 | PRKAG1 (0.47) | NPC1RAB9ASMN1; SMN2SLC29A1NR2F2 |
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-2511283-A1 | N6-SUBSTITUTED ADENOSINE DERIVATIVES, N6-SUBSTITUTED ADENINE DERIVATIVES AND USES THEREOF | INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) | 2012-10-17 | — | — | EP | disclosed |