Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.43 |
| ▸ | MAP1LC3A | Q9H492 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 7/20 | 0.41 |
| ▸ | CAMK2D | Q13557 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | CTSV | O60911 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31232266 | 1.00 | KDM4E (0.44) | KDM4EALDH1A1SMN1; SMN2MAP1LC3BMAP1LC3A | |
| SCHEMBL29135937 | 0.89 | MAP1LC3B (0.43) | KDM4EALDH1A1SMN1; SMN2MAP1LC3BMAP1LC3A | |
| SCHEMBL29778409 | 0.89 | MAP1LC3B (0.43) | KDM4EALDH1A1SMN1; SMN2MAP1LC3BMAP1LC3A | |
| SCHEMBL29778402 | 0.89 | KDM4E (0.40) | KDM4EALDH1A1SMN1; SMN2HPGDGAA | |
| SCHEMBL24616874 | 0.89 | KDM4E (0.40) | KDM4EALDH1A1SMN1; SMN2HPGDGAA | |
| SCHEMBL24616956 | 0.87 | MAP1LC3B (0.47) | KDM4EALDH1A1SMN1; SMN2MAP1LC3BMAP1LC3A | |
| SCHEMBL29778481 | 0.86 | MAP1LC3B (0.43) | MAP1LC3BMAP1LC3AROCK2ROCK1CTSV | |
| SCHEMBL24616895 | 0.85 | MAP1LC3B (0.44) | MAP1LC3BMAP1LC3AROCK2ROCK1CTSV | |
| SCHEMBL29778567 | 0.85 | MAP1LC3B (0.44) | MAP1LC3BMAP1LC3AROCK2ROCK1CTSV | |
| SCHEMBL24616902 | 0.85 | MAP1LC3B (0.43) | ALDH1A1MAP1LC3BMAP1LC3AROCK2ROCK1 |
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 3 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 |
| WO-2022150381-A1 | SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND USES THEREOF | Genosco Inc. (US) | 2022-07-14 | — | — | WO | disclosed |