Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | PPARA | Q07869 | 4/20 | 0.62 |
| ▸ | PPARG | P37231 | 2/20 | 0.62 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | LPL | P06858 | 2/20 | 0.55 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.55 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.54 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.53 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.53 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL15199282 | 1.00 | ALDH1A1 (0.67) | ALDH1A1PPARAPPARGHPGDHSD17B10 | |
| Setogepram SCHEMBL29395927 | 0.98 | ALDH1A1 (0.69) | ALDH1A1PPARAPPARGHPGDHSD17B10 | |
| Setogepram SCHEMBL289216 | 0.98 | ALDH1A1 (0.69) | ALDH1A1PPARAPPARGHPGDHSD17B10 | |
| Setogepram SCHEMBL19095287 | 0.97 | ALDH1A1 (0.67) | ALDH1A1PPARAPPARGHPGDHSD17B10 | |
| Setogepram SCHEMBL19095289 | 0.97 | ALDH1A1 (0.67) | ALDH1A1PPARAPPARGHPGDHSD17B10 | |
| SCHEMBL10963130 | 0.93 | ALDH1A1 (0.68) | ALDH1A1PPARAPPARGHPGDHSD17B10 | |
| SCHEMBL25173309 | 0.87 | MAPT (0.66) | ALDH1A1PPARAPPARGHSD17B10GPR84 | |
| SCHEMBL711512 | 0.87 | MAPT (0.66) | ALDH1A1PPARAPPARGHSD17B10GPR84 | |
| SCHEMBL16050407 | 0.86 | ALDH1A1 (0.70) | ALDH1A1PPARAPPARGHPGDHSD17B10 | |
| SCHEMBL15042342 | 0.86 | AKR1B1 (0.54) | ALDH1A1PPARAPPARGHPGDHSD17B10 |
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-115260448-A | Bio-based diisocyanate, preparation method thereof and polyurethane elastomer | Evoco有限公司 | 2022-11-01 | — | — | CN | disclosed |