Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 13/20 | 0.45 |
| ▸ | JAK3 | P52333 | 11/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4969772 | 0.88 | JAK2 (0.48) | JAK2JAK3SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL4975407 | 0.84 | JAK2 (0.46) | JAK2JAK3SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL4972050 | 0.83 | JAK2 (0.46) | JAK2JAK3NTRK1SMN1; SMN2KCNH2 | |
| SCHEMBL4972182 | 0.82 | JAK2 (0.48) | JAK2JAK3NTRK1SMN1; SMN2KCNH2 | |
| SCHEMBL14675794 | 0.81 | JAK2 (0.64) | JAK2JAK3NTRK1KCNH2 | |
| SCHEMBL4972207 | 0.81 | JAK2 (0.64) | JAK2JAK3NTRK1KCNH2 | |
| SCHEMBL4972038 | 0.80 | JAK2 (0.49) | JAK2JAK3NTRK1SMN1; SMN2KCNH2 | |
| SCHEMBL4972548 | 0.79 | JAK2 (0.46) | JAK2JAK3NTRK1SMN1; SMN2KCNH2 | |
| SCHEMBL4972280 | 0.78 | JAK2 (0.60) | JAK2JAK3NTRK1KCNH2 | |
| SCHEMBL4972215 | 0.77 | JAK2 (0.39) | JAK2JAK3NTRK1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| WO-2008132502-A1 | PYRAZOLYL-AMINO-SUBSTITUTED PYRIMIDINES AND THEIR USE FOR THE TREATMENT OF CANCER | ASTRAZENECA AB (SE) | 2008-11-06 | — | — | WO | disclosed |