Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 2/20 | 0.41 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.38 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.38 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | IGF1R | P08069 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KLK1 | P06870 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | KIT | P10721 | 1/20 | 0.33 |
| ▸ | FLT4 | P35916 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | ILK | Q13418 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29778515 | 1.00 | BRAF (0.41) | BRAFKLKB1MAP4K1EGLN1ROCK2 | |
| SCHEMBL24617245 | 0.85 | ROCK2 (0.42) | KLKB1MAP4K1EGLN1ROCK2ROCK1 | |
| SCHEMBL29778620 | 0.84 | LMNA (0.40) | KLKB1MAP4K1ROCK2ROCK1LMNA | |
| SCHEMBL24617469 | 0.84 | LMNA (0.40) | KLKB1MAP4K1ROCK2ROCK1LMNA | |
| SCHEMBL24617462 | 0.83 | BRD4 (0.38) | KLKB1MAP4K1EGLN1ROCK2ROCK1 | |
| SCHEMBL29778413 | 0.83 | LMNA (0.37) | KLKB1MAP4K1EGLN1ROCK2ROCK1 | |
| SCHEMBL24617467 | 0.83 | LMNA (0.37) | KLKB1MAP4K1EGLN1ROCK2ROCK1 | |
| SCHEMBL24616955 | 0.82 | MAPK1 (0.39) | KLKB1MAP4K1EGLN1ROCK2ROCK1 | |
| SCHEMBL24617487 | 0.82 | LMNA (0.35) | KLKB1MAP4K1EGLN1ROCK2ROCK1 | |
| SCHEMBL29778563 | 0.80 | ROCK2 (0.40) | KLKB1MAP4K1ROCK2ROCK1HSP90AB1 |
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 |