Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 13/20 | 0.37 |
| ▸ | TNF | P01375 | 1/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | LATS1 | O95835 | 2/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | LATS2 | Q9NRM7 | 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 | |
|---|---|---|---|---|
| SCHEMBL23521642 | 0.92 | ROCK2 (0.42) | NAMPTCYP2C9ROCK2TNFAAK1 | |
| SCHEMBL30744178 | 0.91 | AAK1 (0.41) | NAMPTCYP2C9ROCK2TNFAAK1 | |
| SCHEMBL28580894 | 0.91 | AAK1 (0.41) | NAMPTCYP2C9ROCK2TNFAAK1 | |
| SCHEMBL23927682 | 0.90 | ROCK2 (0.44) | NAMPTCYP2C9ROCK2TNFDYRK1A | |
| SCHEMBL23521448 | 0.90 | ROCK2 (0.44) | NAMPTCYP2C9ROCK2TNFDYRK1A | |
| SCHEMBL23501364 | 0.90 | ROCK2 (0.37) | NAMPTCYP2C9ROCK2TNFLATS1 | |
| SCHEMBL29180263 | 0.90 | NAMPT (0.37) | NAMPTCYP2C9ROCK2TNFLATS1 | |
| SCHEMBL30744176 | 0.89 | ROCK2 (0.38) | NAMPTCYP2C9ROCK2TNFDYRK1A | |
| SCHEMBL23963658 | 0.89 | ROCK2 (0.37) | NAMPTCYP2C9ROCK2TNFDYRK1A | |
| SCHEMBL23522326 | 0.87 | ROCK2 (0.38) | NAMPTCYP2C9ROCK2TNFAAK1 |
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-111217834-B | Nitroxide derivatives of ROCK kinase inhibitors | 维眸生物科技（上海）有限公司 | 2021-10-26 | — | — | CN | disclosed |
| CN-111217834-A | Nitroxide derivatives of ROCK kinase inhibitors | 维眸生物科技（上海）有限公司 | 2020-06-02 | — | — | CN | disclosed |