Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.32 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.32 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.32 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20051446 | 0.80 | IRAK4 (0.40) | IRAK4KDM4EALDH1A1L3MBTL1PDE4B | |
| SCHEMBL24023125 | 0.80 | IRAK4 (0.42) | IRAK4KDM4EALDH1A1L3MBTL1GAA | |
| SCHEMBL21187403 | 0.70 | IRAK4 (0.69) | IRAK4ALDH1A1CYP3A4 | |
| SCHEMBL22764057 | 0.68 | MKNK1 (0.38) | IRAK4 | |
| SCHEMBL22767580 | 0.66 | CDK2 (0.36) | IRAK4HCAR3GAA | |
| SCHEMBL30822849 | 0.63 | IRAK4 (0.37) | IRAK4 | |
| SCHEMBL21286732 | 0.63 | IRAK4 (0.37) | IRAK4 | |
| SCHEMBL20273951 | 0.62 | KMT2A (0.47) | IRAK4KDM4E | |
| SCHEMBL3712626 | 0.58 | IRAK4 (0.44) | IRAK4KDM4ELRRK2 | |
| SCHEMBL15655160 | 0.56 | PDE4B (0.44) | IRAK4KDM4EALDH1A1PDE4BGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3509591-B1 | NOVEL JAK1 SELECTIVE INHIBITORS AND USES THEREOF | HIGHLIGHTLL PHARMACEUTICAL HAINAN CO LTD (CN) | 2021-11-17 | — | — | EP | disclosed |
| WO-2018067422-A1 | NOVEL JAK1 SELECTIVE INHIBITORS AND USES THEREOF | LIANG CONGXIN (US) | 2018-04-12 | — | — | WO | disclosed |