Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | GRK2 | P25098 | 1/20 | 0.39 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | FSCN1 | Q16658 | 3/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.36 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.36 |
| ▸ | CECR2 | Q9BXF3 | 1/20 | 0.36 |
| ▸ | DDR2 | Q16832 | 1/20 | 0.36 |
| ▸ | TAF1 | P21675 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29778506 | 1.00 | TDO2 (0.42) | TDO2ROCK2ROCK1MAPK1TNIK | |
| SCHEMBL29136004 | 0.88 | TDO2 (0.41) | TDO2ROCK2ROCK1MAPK1TNIK | |
| SCHEMBL29779026 | 0.88 | TDO2 (0.41) | TDO2ROCK2ROCK1MAPK1TNIK | |
| SCHEMBL30656540 | 0.87 | TDO2 (0.40) | TDO2ROCK2ROCK1MAPK1TNIK | |
| SCHEMBL29135965 | 0.87 | TDO2 (0.40) | TDO2ROCK2ROCK1MAPK1TNIK | |
| SCHEMBL29135932 | 0.86 | TDO2 (0.40) | TDO2ROCK2ROCK1MAPK1TNIK | |
| SCHEMBL29778614 | 0.86 | TDO2 (0.40) | TDO2ROCK2ROCK1MAPK1TNIK | |
| SCHEMBL29135975 | 0.85 | ROCK2 (0.49) | TDO2ROCK2ROCK1MAPK1TNIK | |
| SCHEMBL29778579 | 0.85 | ROCK2 (0.49) | TDO2ROCK2ROCK1MAPK1TNIK | |
| SCHEMBL29136007 | 0.85 | ROCK1 (0.48) | TDO2ROCK2ROCK1MAPK1TNIK |
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-117136186-A | Selective inhibitors of ROCK1 and ROCK2 protein kinases and uses thereof | 盖诺斯克公司 | 2023-11-28 | — | — | CN | claimed |
| CN-117136186-A | Selective inhibitors of ROCK1 and ROCK2 protein kinases and uses thereof | 盖诺斯克公司 | 2023-11-28 | — | — | CN | disclosed |