Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNP | P00491 | 1/20 | 0.35 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | TYMS | P04818 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | QTRT1 | Q9BXR0 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 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 | |
|---|---|---|---|---|
| SCHEMBL9544092 | 0.89 | TYMS (0.34) | HPRT1BACE1TYMSMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL9545316 | 0.81 | XDH (0.33) | PNPQTRT1NOS1 | |
| Hydrochloric Acid SCHEMBL9545280 | 0.76 | HPRT1 (0.34) | PNPHPRT1BACE1TYMSMEN1 | |
| SCHEMBL9544423 | 0.75 | HSD17B10 (0.33) | PNPHPRT1QTRT1DHFR | |
| Hydrochloric Acid SCHEMBL9544734 | 0.75 | DHFR (0.35) | PNPHPRT1BACE1TYMSDHFR | |
| Hydrochloric Acid SCHEMBL9544813 | 0.71 | PNP (0.34) | PNPHPRT1BACE1MEN1KMT2A | |
| SCHEMBL9364441 | 0.70 | HPRT1 (0.60) | PNPHPRT1NOS1 | |
| SCHEMBL9544929 | 0.69 | TYMS (0.34) | TYMSMEN1KMT2ADHFR | |
| Hydrochloric Acid SCHEMBL9544004 | 0.68 | DHFR (0.38) | PNPHPRT1MEN1KMT2ADHFR | |
| SCHEMBL9545264 | 0.66 | XDH (0.35) | PNPTYMSMEN1KMT2AQTRT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993020075-A1 | 8-SUBSTITUTED-N5-DEAZAPTERINS AS ANTIFOLATES | THE UNIVERSITY OF SYDNEY (AU) | 1993-10-14 | — | — | WO | disclosed |