Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.48 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.48 |
| ▸ | CDC42BPB | Q9Y5S2 | 2/20 | 0.48 |
| ▸ | TNIK | Q9UKE5 | 8/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | MAP4K1 | Q92918 | 5/20 | 0.45 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.45 |
| ▸ | IL2 | P60568 | 3/20 | 0.45 |
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28507178 | 0.88 | TNIK (0.50) | ROCK2ROCK1CDC42BPBTNIKCHEK1 | |
| SCHEMBL28502014 | 0.86 | MAP4K1 (0.58) | ROCK2ROCK1TNIKMAP4K1IL2 | |
| SCHEMBL21590294 | 0.84 | ROCK2 (0.52) | ROCK2ROCK1CDC42BPBTNIKCHEK1 | |
| SCHEMBL28504488 | 0.83 | MAP4K1 (0.59) | MAP4K1IL2DYRK1A | |
| SCHEMBL28499623 | 0.82 | CHEK1 (0.46) | TNIKCHEK1MAP4K1IL2DYRK1A | |
| SCHEMBL21590290 | 0.81 | MAP4K1 (0.64) | TNIKCHEK1ACHEMAP4K1IL2 | |
| SCHEMBL28905284 | 0.81 | SGK1 (0.57) | TNIKMAP4K1IL2 | |
| SCHEMBL28502428 | 0.80 | RIPK1 (0.54) | ROCK2ROCK1CDC42BPBTNIKCHEK1 | |
| SCHEMBL21592605 | 0.79 | MAP4K1 (0.58) | TNIKMAP4K1IL2 | |
| SCHEMBL28502295 | 0.79 | MAP4K1 (0.60) | ROCK2ROCK1TNIKMAP4K1IL2 |
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-112243439-A | Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-01-19 | — | — | CN | disclosed |