Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.49 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.49 |
| ▸ | CDC42BPB | Q9Y5S2 | 2/20 | 0.49 |
| ▸ | CDC42BPA | Q5VT25 | 2/20 | 0.49 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.46 |
| ▸ | ABL1 | P00519 | 2/20 | 0.45 |
| ▸ | INSR | P06213 | 2/20 | 0.45 |
| ▸ | CDK2 | P24941 | 2/20 | 0.45 |
| ▸ | FLT3 | P36888 | 2/20 | 0.45 |
| ▸ | IKBKB | O14920 | 1/20 | 0.45 |
| ▸ | CHUK | O15111 | 1/20 | 0.45 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.45 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | TNIK | Q9UKE5 | 4/20 | 0.43 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.41 |
| ▸ | MTOR | P42345 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28502428 | 0.96 | RIPK1 (0.54) | RIPK1ROCK2ROCK1CDC42BPBCDC42BPA | |
| SCHEMBL28506598 | 0.83 | RIPK1 (0.49) | RIPK1ROCK2ROCK1CDC42BPADYRK1A | |
| SCHEMBL28506118 | 0.82 | DYRK1A (0.51) | RIPK1ROCK2ROCK1CDC42BPADYRK1A | |
| SCHEMBL21590294 | 0.81 | ROCK2 (0.52) | ROCK2ROCK1CDC42BPBCDC42BPADYRK1A | |
| SCHEMBL28514903 | 0.80 | MAPK1 (0.51) | RIPK1ROCK2ROCK1CDC42BPBCDC42BPA | |
| SCHEMBL21590316 | 0.80 | DYRK1A (0.49) | RIPK1ROCK2ROCK1CDC42BPADYRK1A | |
| SCHEMBL28504554 | 0.79 | BRD4 (0.58) | RIPK1ROCK2ROCK1CDC42BPADYRK1A | |
| SCHEMBL28905250 | 0.78 | DYRK1A (0.48) | RIPK1ROCK2ROCK1CDC42BPADYRK1A | |
| SCHEMBL28502220 | 0.77 | DYRK1A (0.54) | RIPK1ROCK2ROCK1DYRK1AABL1 | |
| SCHEMBL28499630 | 0.77 | FLT3 (0.56) | RIPK1DYRK1AABL1INSRCDK2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| WO-2019238067-A1 | PYRROLO [2, 3-B] PYRIDINES OR PYRROLO [2, 3-B] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2019-12-19 | — | — | WO | disclosed |