Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 10/20 | 0.36 |
| ▸ | GPR174 | Q9BXC1 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28405614 | 0.87 | IRAK4 (0.38) | IRAK4 | |
| SCHEMBL28407983 | 0.81 | IRAK4 (0.39) | MAPTCYP3A4BLMPMP22IRAK4 | |
| SCHEMBL20594509 | 0.78 | MAPT (0.52) | MAPTCYP3A4BLMPMP22IRAK4 | |
| SCHEMBL19030428 | 0.78 | MAPT (0.45) | MAPTIRAK4GPR174LMNAGAA | |
| SCHEMBL20594582 | 0.76 | MAPT (0.44) | MAPTCYP3A4BLMPMP22IRAK4 | |
| SCHEMBL19030476 | 0.76 | IRAK4 (0.49) | MAPTCYP3A4BLMPMP22IRAK4 | |
| SCHEMBL19030119 | 0.75 | MAPT (0.46) | MAPTIRAK4GPR174LMNAGAA | |
| SCHEMBL19030463 | 0.75 | MAPT (0.48) | MAPTIRAK4GPR174LMNAGAA | |
| SCHEMBL19046011 | 0.75 | ALDH1A1 (0.49) | MAPTCYP3A4GPR174LMNAGAA | |
| SCHEMBL19030707 | 0.74 | IRAK4 (0.48) | MAPTIRAK4LMNAGAACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111094292-A | Pyrazolo [1,5a ] pyrimidine derivatives as IRAK4 modulators | 豪夫迈·罗氏有限公司 | 2020-05-01 | — | — | CN | disclosed |