Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29899326 | 0.86 | ROCK2 (0.43) | ROCK2GABRA1GABRB2 | |
| SCHEMBL2727228 | 0.71 | ROCK2 (0.49) | ROCK2GABRA1GABRB2PTGS2 | |
| Phosphine SCHEMBL27043067 | 0.69 | ROCK2 (0.48) | ROCK2GABRA1GABRB2PTGS2 | |
| SCHEMBL29424818 | 0.69 | ROCK2 (0.48) | ROCK2GABRA1GABRB2PTGS2 | |
| SCHEMBL30842176 | 0.69 | ROCK2 (0.48) | ROCK2GABRA1GABRB2 | |
| SCHEMBL15833732 | 0.68 | GABRA1 (0.48) | GABRA1GABRB2 | |
| Biphenyl SCHEMBL30634889 | 0.66 | ALDH1A1 (0.53) | — | |
| Biphenyl SCHEMBL2052974 | 0.66 | ALDH1A1 (0.53) | — | |
| SCHEMBL8134144 | 0.65 | GABRA1 (0.42) | GABRA1GABRB2 | |
| Biphenyl SCHEMBL11314785 | 0.64 | ALDH1A1 (0.53) | PTGS2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116710453-A | Kinase inhibitors and uses thereof | 璧辰医药技术股份有限公司 | 2023-09-05 | — | — | CN | disclosed |