Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 10/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30165667 | 1.00 | MAP4K1 (0.43) | MAP4K1ALOX5PTGS2CYP3A4CYP2D6 | |
| SCHEMBL19994364 | 1.00 | MAP4K1 (0.43) | MAP4K1ALOX5PTGS2CYP3A4CYP2D6 | |
| SCHEMBL25676559 | 0.78 | MAP4K1 (0.46) | MAP4K1PTGS2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL31334702 | 0.78 | MAP4K1 (0.41) | MAP4K1PTGS2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4780 | 0.78 | ALOX5 (0.46) | MAP4K1ALOX5GRIN2DGRIN3BGRIN1 | |
| SCHEMBL3297331 | 0.77 | PTGS2 (0.43) | MAP4K1PTGS2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29464219 | 0.76 | PARP1 (0.48) | MAP4K1ALOX5CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL19994372 | 0.76 | PARP1 (0.48) | MAP4K1ALOX5CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL31334775 | 0.75 | PARP1 (0.47) | MAP4K1ALOX5CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL19994341 | 0.75 | PARP1 (0.47) | MAP4K1ALOX5CYP3A4CYP2D6CYP2C9 |
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-110402248-B | Azaindoles as HPK1 inhibitors | 豪夫迈·罗氏有限公司 | 2023-01-06 | — | — | CN | disclosed |