Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 6/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.42 |
| ▸ | CSNK1E | P49674 | 2/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.41 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.41 |
| ▸ | BRAF | P15056 | 6/20 | 0.41 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.39 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28976167 | 0.90 | TGFBR1 (0.42) | IRAK4CSNK1DCSNK1ETGFBR1TGFBR2 | |
| SCHEMBL29911609 | 0.89 | IRAK4 (0.48) | IRAK4CSNK1DCSNK1ETGFBR1TGFBR2 | |
| SCHEMBL29911584 | 0.84 | BRAF (0.44) | IRAK4CSNK1DCSNK1ETGFBR1TGFBR2 | |
| SCHEMBL29911772 | 0.83 | TGFBR1 (0.38) | IRAK4ADORA2AADORA2BADORA1TGFBR1 | |
| SCHEMBL29911649 | 0.83 | TGFBR1 (0.40) | IRAK4CSNK1DCSNK1ETGFBR1TGFBR2 | |
| SCHEMBL29911701 | 0.83 | BRAF (0.45) | IRAK4ADORA2AADORA2BADORA1TGFBR1 | |
| SCHEMBL30051471 | 0.82 | BRAF (0.41) | IRAK4ADORA2AADORA2BADORA1CSNK1D | |
| SCHEMBL29911597 | 0.81 | HTR2A (0.39) | IRAK4CSNK1DCSNK1ETGFBR1TGFBR2 | |
| SCHEMBL29911648 | 0.80 | IRAK4 (0.46) | IRAK4CSNK1DCSNK1ETGFBR1BRAF | |
| SCHEMBL29911689 | 0.79 | ADORA2A (0.43) | ADORA2AADORA2BADORA1TGFBR1TGFBR2 |
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 4 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-110234637-B | Pyrazole amide compounds useful as IRAK inhibitors | 里格尔药品股份有限公司 | 2022-11-01 | — | — | 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 |