Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKAG1 | P54619 | 1/20 | 0.52 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.52 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.52 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.51 |
| ▸ | ABL1 | P00519 | 2/20 | 0.49 |
| ▸ | RIN1 | Q13671 | 2/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13467459 | 0.89 | ABL1 (0.56) | PRKAG1PRKAA1PRKAB1NR2F2ABL1 | |
| SCHEMBL12579207 | 0.85 | SLC29A1 (0.57) | PRKAG1PRKAA1PRKAB1ADORA3ADORA2A | |
| SCHEMBL13467484 | 0.82 | PRKAG1 (0.53) | PRKAG1PRKAA1PRKAB1NR2F2ABL1 | |
| SCHEMBL14713325 | 0.81 | PRKAG1 (0.78) | PRKAG1PRKAA1PRKAB1ADORA3ADORA2A | |
| SCHEMBL20626267 | 0.81 | PRKAG1 (0.78) | PRKAG1PRKAA1PRKAB1ADORA3ADORA2A | |
| SCHEMBL20626268 | 0.81 | PRKAG1 (0.78) | PRKAG1PRKAA1PRKAB1ADORA3ADORA2A | |
| SCHEMBL14714100 | 0.81 | PRKAG1 (0.78) | PRKAG1PRKAA1PRKAB1ADORA3ADORA2A | |
| SCHEMBL13467469 | 0.80 | PAX8 (0.52) | PRKAG1PRKAA1PRKAB1ADORA2AALDH1A1 | |
| SCHEMBL13467564 | 0.80 | ABL1 (0.49) | NR2F2ABL1RIN1TP53CYP3A4 | |
| SCHEMBL2041441 | 0.79 | YTHDC1 (0.59) | ABL1RIN1ADORA3ALDH1A1 |
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 |