Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 9/20 | 0.78 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6649605 | 0.88 | TYMS (1.00) | TYMSDHFR | |
| SCHEMBL7990232 | 0.81 | TYMS (0.78) | TYMSDHFR | |
| SCHEMBL7501783 | 0.81 | TYMS (0.78) | TYMSDHFR | |
| SCHEMBL6654917 | 0.78 | TYMS (0.60) | TYMSDHFR | |
| SCHEMBL6654911 | 0.78 | TYMS (0.60) | TYMSDHFR | |
| SCHEMBL6446395 | 0.78 | TYMS (0.77) | TYMS | |
| SCHEMBL6446404 | 0.78 | TYMS (0.77) | TYMS | |
| SCHEMBL6447640 | 0.77 | TYMS (0.52) | TYMSDHFRPDE3BPDE3AP2RY12 | |
| SCHEMBL7258233 | 0.76 | TYMS (0.73) | TYMS | |
| SCHEMBL9422199 | 0.74 | TYMS (0.55) | TYMSDHFR |
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 |
|---|---|---|---|---|---|---|---|
| US-6306865-B1 | SYNTHASE INHIBITORS AND ANTITUMOR AGENTS | GLAXO WELLCOME INC. | 2001-10-23 | — | — | US | disclosed |