Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22836000 | 1.00 | MAOA (0.36) | MAOAALDH1A1KDM4EPOLBCYP3A4 | |
| SCHEMBL26353445 | 1.00 | MAOA (0.36) | MAOAALDH1A1KDM4EPOLBCYP3A4 | |
| SCHEMBL28731544 | 0.84 | ALDH1A1 (0.36) | MAOAALDH1A1KDM4E | |
| SCHEMBL22835245 | 0.84 | SCN1A (0.38) | MAOAALDH1A1 | |
| SCHEMBL28731543 | 0.84 | ALDH1A1 (0.36) | MAOAALDH1A1KDM4E | |
| SCHEMBL26353444 | 0.84 | SCN1A (0.38) | MAOAALDH1A1 | |
| SCHEMBL22836453 | 0.81 | SCN1A (0.38) | MAOAALDH1A1 | |
| SCHEMBL29502492 | 0.81 | SCN1A (0.38) | MAOAALDH1A1 | |
| SCHEMBL26353603 | 0.81 | SCN1A (0.38) | MAOAALDH1A1 | |
| SCHEMBL22835772 | 0.80 | MAPT (0.45) | ALDH1A1KDM4ECYP3A4CYP2C9 |
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-114437035-A | Compound for inhibiting and degrading IRAK4, pharmaceutical composition and pharmaceutical application thereof | 海思科医药集团股份有限公司 | 2022-05-06 | — | — | CN | disclosed |