Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7440443 | 0.93 | NQO1 (0.36) | ALDH1A1MAPTNQO1HPGD | |
| SCHEMBL7440645 | 0.92 | NQO1 (0.36) | ALDH1A1NPSR1MAPTNQO1HTT | |
| SCHEMBL7441300 | 0.82 | NQO1 (0.41) | ALDH1A1MAPTNQO1LMNAHPGD | |
| SCHEMBL7437926 | 0.81 | ESR1 (0.39) | ALDH1A1MAPTNQO1HPGD | |
| SCHEMBL7440300 | 0.80 | NQO1 (0.33) | NQO1 | |
| SCHEMBL9196771 | 0.80 | NQO1 (0.31) | NQO1 | |
| SCHEMBL7447834 | 0.80 | NQO1 (0.37) | ALDH1A1MAPTNQO1HTTLMNA | |
| SCHEMBL7443023 | 0.80 | NQO1 (0.37) | ALDH1A1MAPTNQO1LMNAHPGD | |
| SCHEMBL7440515 | 0.80 | NQO1 (0.40) | NPSR1MAPTNQO1LMNANPC1 | |
| SCHEMBL7444897 | 0.79 | NQO1 (0.36) | ALDH1A1MAPTNQO1HPGD |
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-1994011361-A1 | PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES | THE UPJOHN COMPANY (US) | 1994-05-26 | — | — | WO | disclosed |