Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | OGT | O15294 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.43 |
| ▸ | F11 | P03951 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | S100B | P04271 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1055214 | 0.86 | GRIN2D (0.53) | CA12CA9EHMT2LMNAOGT | |
| SCHEMBL31475450 | 0.81 | CA12 (0.51) | CA12CA9EHMT2LMNAOGT | |
| SCHEMBL1081628 | 0.80 | CA12 (0.46) | CA12CA9EHMT2LMNAOGT | |
| SCHEMBL4553222 | 0.80 | GRIN2D (0.57) | CA12CA9EHMT2LMNAOGT | |
| SCHEMBL16431845 | 0.80 | F11 (0.50) | CA12CA9EHMT2LMNAOGT | |
| SCHEMBL30908253 | 0.78 | CA12 (0.51) | CA12CA9LMNAOGTTP53 | |
| SCHEMBL16431802 | 0.78 | CA12 (0.44) | CA12CA9EHMT2LMNAOGT | |
| SCHEMBL18822108 | 0.77 | CA12 (0.55) | CA12CA9MAPTGRIN2DGRIN3B | |
| SCHEMBL24638108 | 0.77 | F11 (0.50) | CA12CA9EHMT2LMNAOGT | |
| SCHEMBL28820841 | 0.77 | CA12 (0.50) | CA12CA9LMNAOGTTP53 |
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-3252054-A1 | PYRAZOLO[1,5A]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS | F. Hoffmann-La Roche AG (CH) | 2017-12-06 | — | — | EP | disclosed |