Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.42 |
| ▸ | YTHDF2 | Q9Y5A9 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.39 |
| ▸ | JAK1 | P23458 | 2/20 | 0.39 |
| ▸ | JAK3 | P52333 | 2/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | TTK | P33981 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14015017 | 0.78 | ADORA2A (0.57) | ALDH1A1RAB9ASMN1; SMN2KDM4EHAO1 | |
| SCHEMBL14015023 | 0.72 | KDM4E (0.58) | ALDH1A1RAB9ASMN1; SMN2KDM4ETTK | |
| SCHEMBL14015009 | 0.72 | ALDH1A1 (0.45) | ALDH1A1RAB9ASMN1; SMN2KDM4ETTK | |
| SCHEMBL11222623 | 0.71 | HTT (0.53) | HTTALDH1A1RAB9ASMN1; SMN2HAO1 | |
| SCHEMBL14015019 | 0.70 | TTK (0.48) | ALDH1A1RAB9ASMN1; SMN2KDM4EHAO1 | |
| SCHEMBL14015020 | 0.70 | KDM4E (0.45) | ALDH1A1RAB9ASMN1; SMN2KDM4EHAO1 | |
| SCHEMBL5247702 | 0.68 | ALDH1A1 (0.46) | HTTALDH1A1YTHDC1YTHDF2RAB9A | |
| SCHEMBL19352727 | 0.66 | NUDT14 (0.44) | RAB9ALTA4HNPC1 | |
| SCHEMBL4273485 | 0.64 | HTT (0.61) | HTTALDH1A1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL8880504 | 0.64 | HTT (1.00) | HTTALDH1A1RAB9ASMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-7452880-B2 | Substituted pyrazolo [3,4-d] pyrimidines and methods of using the same | F. HOFFMANN-LA ROCHE AG (CH) | 2008-11-18 | — | — | US | disclosed |