Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.49 |
| ▸ | MAPT | P10636 | 10/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28664972 | 0.83 | MAPK13 (0.37) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL19030013 | 0.76 | ALDH1A1 (0.47) | ALDH1A1MAPTCYP2C9CYP2C19KDM4E | |
| SCHEMBL19030682 | 0.74 | IRAK4 (0.49) | ALDH1A1MAPTCYP2C9CYP2C19KDM4E | |
| SCHEMBL19030464 | 0.72 | ALDH1A1 (0.47) | ALDH1A1MAPTCYP2C9CYP2C19MEN1 | |
| SCHEMBL28663651 | 0.72 | ALDH1A1 (0.37) | ALDH1A1MAPTMEN1KMT2AL3MBTL1 | |
| SCHEMBL19030431 | 0.70 | IRAK4 (0.50) | ALDH1A1MAPTCYP2C9CYP2C19KDM4E | |
| SCHEMBL26352330 | 0.70 | MAPT (0.45) | ALDH1A1MAPTCYP2C9CYP2C19KDM4E | |
| SCHEMBL19030128 | 0.70 | IRAK4 (0.52) | — | |
| SCHEMBL19029877 | 0.70 | IRAK4 (0.48) | ALDH1A1MAPTCYP2C9CYP2C19KMT2A | |
| SCHEMBL19030167 | 0.69 | MAPT (0.44) | ALDH1A1MAPTMEN1KMT2AL3MBTL1 |
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-108473498-B | Pyrazolo [1,5a ] pyrimidine derivatives as IRAK4 modulators | 豪夫迈·罗氏有限公司 | 2021-11-02 | — | — | CN | disclosed |