Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.80 |
| ▸ | HPGD | P15428 | 1/20 | 0.80 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.80 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.80 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29623278 | 0.89 | ALDH1A1 (1.00) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL354679 | 0.89 | ALDH1A1 (1.00) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| Water SCHEMBL29724498 | 0.88 | ALDH1A1 (0.96) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL28888127 | 0.88 | ALDH1A1 (0.96) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7808078 | 0.88 | ALDH1A1 (0.96) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL8174635 | 0.84 | ALDH1A1 (0.55) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL28571 | 0.82 | PDE10A (0.52) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL3829125 | 0.81 | ALDH1A1 (0.83) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| SCHEMBL8699526 | 0.80 | ALDH1A1 (0.80) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 | |
| Formaldehyde SCHEMBL28095446 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2 |
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-1273276-A | Microbiological inversion of 2-methyl-quinoxaline | PFIZER PRODUCT CORP (US) | 2000-11-15 | — | — | CN | disclosed |