Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKD3 | O94806 | 3/20 | 0.60 |
| ▸ | PRKCG | P05129 | 3/20 | 0.60 |
| ▸ | PRKCB | P05771 | 3/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.60 |
| ▸ | PRKCA | P17252 | 3/20 | 0.60 |
| ▸ | PRKCH | P24723 | 3/20 | 0.60 |
| ▸ | PRKCI | P41743 | 3/20 | 0.60 |
| ▸ | PRKCE | Q02156 | 3/20 | 0.60 |
| ▸ | PRKCQ | Q04759 | 3/20 | 0.60 |
| ▸ | PRKCZ | Q05513 | 3/20 | 0.60 |
| ▸ | PRKCD | Q05655 | 3/20 | 0.60 |
| ▸ | PRKD1 | Q15139 | 3/20 | 0.60 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.60 |
| ▸ | PRKACA | P17612 | 2/20 | 0.60 |
| ▸ | PRKACG | P22612 | 2/20 | 0.60 |
| ▸ | PRKACB | P22694 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | ROCK2 | O75116 | 13/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL30423021 | 1.00 | PRKD3 (0.60) | PRKD3PRKCGPRKCBCYP3A4PRKCA | |
| SCHEMBL13497829 | 0.82 | ROCK2 (0.68) | PRKD3PRKCGPRKCBCYP3A4PRKCA | |
| SCHEMBL29770053 | 0.80 | ROCK2 (0.77) | PRKD3PRKCGPRKCBCYP3A4PRKCA | |
| SCHEMBL7029110 | 0.79 | PRKD3 (0.57) | PRKD3PRKCGPRKCBCYP3A4PRKCA | |
| SCHEMBL7315948 | 0.79 | PRKD3 (0.74) | PRKD3PRKCGPRKCBCYP3A4PRKCA | |
| SCHEMBL10988523 | 0.78 | ROCK2 (0.79) | PRKD3PRKCGPRKCBCYP3A4PRKCA | |
| SCHEMBL13497835 | 0.78 | ROCK2 (0.64) | PRKD3PRKCGPRKCBCYP3A4PRKCA | |
| SCHEMBL2902584 | 0.78 | CYP3A4 (0.72) | PRKD3PRKCGPRKCBCYP3A4PRKCA | |
| SCHEMBL6916059 | 0.77 | ROCK2 (0.77) | PRKD3PRKCGPRKCBCYP3A4PRKCA | |
| SCHEMBL10985139 | 0.77 | ROCK2 (0.77) | PRKD3PRKCGPRKCBCYP3A4PRKCA |
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-116375685-B | Fasudil derivative and preparation method and application thereof | 沈阳药科大学 | 2023-12-12 | — | — | CN | disclosed |
| CN-116375685-A | Fasudil derivative and preparation method and application thereof | 沈阳药科大学 | 2023-07-04 | — | — | CN | disclosed |