Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 9/20 | 0.44 |
| ▸ | JAK3 | P52333 | 9/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | ATR | Q13535 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 4/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16729255 | 0.95 | ACKR3 (0.46) | JAK2JAK3CHRM4ACKR3ATR | |
| SCHEMBL16729338 | 0.95 | ACKR3 (0.46) | JAK2JAK3CHRM4ACKR3ATR | |
| SCHEMBL16729336 | 0.95 | ACKR3 (0.46) | JAK2JAK3CHRM4ACKR3ATR | |
| SCHEMBL16718898 | 0.92 | CHRM4 (0.50) | JAK2JAK3CHRM4ACKR3ATR | |
| SCHEMBL16729253 | 0.91 | JAK2 (0.46) | JAK2JAK3CHRM4ACKR3ATR | |
| SCHEMBL16718864 | 0.89 | GRM4 (0.41) | JAK2JAK3CHRM4ACKR3KMT2A | |
| Trifluoroacetic Acid SCHEMBL16718895 | 0.85 | DPP4 (0.49) | JAK2JAK3CHRM4ATRJAK1 | |
| SCHEMBL16729339 | 0.85 | KDM4E (0.49) | JAK2JAK3CHRM4GRM4JAK1 | |
| SCHEMBL16718861 | 0.83 | ACKR3 (0.45) | JAK2JAK3CHRM4ACKR3GRM4 | |
| SCHEMBL16718850 | 0.80 | GRM4 (0.47) | JAK2JAK3CHRM4ACKR3ATR |
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-2015073267-A1 | SUBSTITUTED HETEROARYL COMPOUNDS AND METHODS OF USE | CALITOR SCIENCES, LLC (US) | 2015-05-21 | — | — | WO | disclosed |