Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | CDC7 | O00311 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.43 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.43 |
| ▸ | CCNC | P24863 | 1/20 | 0.43 |
| ▸ | CDK8 | P49336 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25127562 | 0.79 | KDM4E (0.39) | HSD17B10KDM4ERPS6KA3ALDH1A1DRD1 | |
| SCHEMBL19998587 | 0.76 | RPS6KA3 (0.53) | GSK3BCDC7ROCK2MAP4K4PRKACA | |
| SCHEMBL31470912 | 0.76 | RPS6KA3 (0.61) | GSK3BCDC7ROCK2MAP4K4PRKACA | |
| SCHEMBL25256670 | 0.76 | GAA (0.52) | GSK3BCDC7ROCK2MAP4K4PRKACA | |
| SCHEMBL3306203 | 0.75 | CYP2A6 (0.54) | GSK3BCDC7ROCK2MAP4K4PRKACA | |
| SCHEMBL2556432 | 0.75 | ALDH1A1 (0.43) | MKNK2DHODHHSD17B10KDM4ERPS6KA3 | |
| SCHEMBL31301252 | 0.73 | GSK3B (0.59) | GSK3BCDC7ROCK2MAP4K4PRKACA | |
| SCHEMBL2343458 | 0.73 | CYP2A6 (0.58) | HSD17B10ALDH1A1GAADRD1 | |
| SCHEMBL279908 | 0.72 | MAPT (0.55) | HSD17B10KDM4EALDH1A1DRD1 | |
| SCHEMBL15331673 | 0.71 | KDM4C (0.46) | DHODHKDM4ERPS6KA3ALDH1A1 |
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-117430570-A | Rhodamine acetic acid compound, and pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2024-01-23 | — | — | CN | disclosed |