Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 1.00 |
| ▸ | HPGD | P15428 | 2/20 | 1.00 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 1.00 |
| ▸ | CDC7 | O00311 | 4/20 | 0.84 |
| ▸ | PIM1 | P11309 | 2/20 | 0.66 |
| ▸ | GSK3B | P49841 | 2/20 | 0.66 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.66 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.66 |
| ▸ | CLK1 | P49759 | 1/20 | 0.66 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.66 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.66 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.64 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.64 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.64 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.64 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.64 |
| ▸ | CDK1 | P06493 | 1/20 | 0.64 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.64 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL28539861 | 0.90 | KDM4E (0.81) | KDM4EALDH1A1HPGDHSD17B10CDC7 | |
| SCHEMBL385565 | 0.90 | KDM4E (0.81) | KDM4EALDH1A1HPGDHSD17B10CDC7 | |
| SCHEMBL385542 | 0.90 | KDM4E (0.81) | KDM4EALDH1A1HPGDHSD17B10CDC7 | |
| SCHEMBL29699598 | 0.90 | KDM4E (0.81) | KDM4EALDH1A1HPGDHSD17B10CDC7 | |
| SCHEMBL384812 | 0.86 | KDM4E (0.74) | KDM4EALDH1A1HPGDHSD17B10CDC7 | |
| SCHEMBL384902 | 0.85 | KDM4E (0.73) | KDM4EALDH1A1HPGDHSD17B10CDC7 | |
| SCHEMBL385118 | 0.85 | KDM4E (0.73) | KDM4EALDH1A1HPGDHSD17B10CDC7 | |
| SCHEMBL385292 | 0.85 | CDC7 (0.76) | KDM4EALDH1A1HPGDHSD17B10CDC7 | |
| SCHEMBL383396 | 0.81 | CDC7 (0.72) | KDM4EALDH1A1HPGDHSD17B10CDC7 | |
| SCHEMBL385371 | 0.81 | CDC7 (0.72) | KDM4EALDH1A1HPGDHSD17B10CDC7 |
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-107266372-B | Method for catalytic synthesis of 4,6-diaryl pyrimidine-2 (1H) -ketone derivative by sulfonic acid functionalized chitosan | 南阳理工学院 | 2020-11-17 | — | — | CN | disclosed |