Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 4/20 | 0.51 |
| ▸ | CDC7 | O00311 | 2/20 | 0.51 |
| ▸ | CDK9 | P50750 | 2/20 | 0.51 |
| ▸ | AURKA | O14965 | 3/20 | 0.50 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.50 |
| ▸ | INCENP | Q9NQS7 | 3/20 | 0.50 |
| ▸ | TPX2 | Q9ULW0 | 3/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.47 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.47 |
| ▸ | KIT | P10721 | 5/20 | 0.46 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.44 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 3/20 | 0.44 |
| ▸ | CLK2 | P49760 | 3/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.43 |
| ▸ | CLK3 | P49761 | 2/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL20919997 | 0.99 | PIM1 (0.50) | PIM1CDC7CDK9AURKAAURKB | |
| SCHEMBL28904590 | 0.84 | KIT (0.48) | AURKAAURKBINCENPTPX2ROCK2 | |
| SCHEMBL22568789 | 0.84 | CDC7 (0.47) | PIM1CDC7CDK9KIT | |
| SCHEMBL20928145 | 0.82 | KIT (0.51) | AURKAAURKBINCENPTPX2KIT | |
| SCHEMBL20927905 | 0.81 | KIT (0.53) | AURKAAURKBINCENPTPX2KIT | |
| SCHEMBL22568639 | 0.81 | ALDH1A1 (0.51) | AURKAAURKBINCENPTPX2KIT | |
| SCHEMBL22568621 | 0.81 | KIT (0.51) | AURKAAURKBINCENPTPX2KIT | |
| SCHEMBL24615541 | 0.81 | AURKA (0.48) | AURKAAURKBINCENPTPX2ROCK2 | |
| Hydrochloric Acid SCHEMBL29772761 | 0.80 | AURKA (0.47) | AURKAAURKBINCENPTPX2ROCK2 | |
| SCHEMBL22568711 | 0.80 | IDE (0.52) | AURKAAURKBINCENPTPX2KIT |
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-111566102-B | Substituted pyrrolopyridines as activin receptor-like kinase inhibitors | 缆图药品公司 | 2023-09-08 | — | — | CN | disclosed |