Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 9/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | BRAF | P15056 | 2/20 | 0.36 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.36 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | APAF1 | O14727 | 1/20 | 0.33 |
| ▸ | NSD2 | O96028 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29911729 | 0.83 | IRAK4 (0.47) | TGFBR1ADORA2AADORA2BADORA1MAPK1 | |
| SCHEMBL30051471 | 0.83 | BRAF (0.41) | TGFBR1ADORA2AADORA2BADORA1MAPK1 | |
| SCHEMBL20086033 | 0.76 | IRAK4 (0.51) | IRAK4 | |
| SCHEMBL29911516 | 0.75 | TGFBR1 (0.39) | TGFBR1MAPK1BRAFMAPK3TGFBR2 | |
| SCHEMBL28976167 | 0.74 | TGFBR1 (0.42) | TGFBR1MAPK1BRAFMAPK3TGFBR2 | |
| SCHEMBL29911701 | 0.74 | BRAF (0.45) | TGFBR1ADORA2AADORA2BADORA1MAPK1 | |
| SCHEMBL29911609 | 0.73 | IRAK4 (0.48) | TGFBR1BRAFTGFBR2IRAK4ALDH1A1 | |
| SCHEMBL29911596 | 0.73 | TGFBR1 (0.37) | TGFBR1MAPK1BRAFMAPK3TGFBR2 | |
| SCHEMBL29911689 | 0.72 | ADORA2A (0.43) | TGFBR1ADORA2AADORA2BADORA1TGFBR2 | |
| SCHEMBL29911584 | 0.70 | BRAF (0.44) | TGFBR1MAPK1BRAFMAPK3TGFBR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115531387-A | Pyrazole amide compounds useful as IRAK inhibitors | 里格尔药品股份有限公司 | 2022-12-30 | — | — | CN | claimed |
| CN-115531387-A | Pyrazole amide compounds useful as IRAK inhibitors | 里格尔药品股份有限公司 | 2022-12-30 | — | — | CN | disclosed |
| CN-110234637-B | Pyrazole amide compounds useful as IRAK inhibitors | 里格尔药品股份有限公司 | 2022-11-01 | — | — | CN | disclosed |