Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | ERN1 | O75460 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29096536 | 1.00 | ALDH1A1 (0.47) | ALDH1A1GAATAAR1MAOBERN1 | |
| SCHEMBL29096531 | 0.92 | ERN1 (0.45) | ALDH1A1GAATAAR1ERN1HPGD | |
| SCHEMBL29096535 | 0.92 | ERN1 (0.45) | ALDH1A1GAATAAR1ERN1HPGD | |
| SCHEMBL29096538 | 0.87 | MEN1 (0.45) | ALDH1A1GAAMAOBERN1MEN1 | |
| SCHEMBL29096542 | 0.87 | MEN1 (0.45) | ALDH1A1GAAMAOBERN1MEN1 | |
| SCHEMBL29096530 | 0.84 | MAPT (0.40) | ALDH1A1HPGDCYP3A4MEN1KMT2A | |
| SCHEMBL29096533 | 0.84 | MAPT (0.40) | ALDH1A1HPGDCYP3A4MEN1KMT2A | |
| SCHEMBL29096544 | 0.83 | ADORA2A (0.41) | MAOBMEN1KMT2AADORA2ANPC1 | |
| SCHEMBL29096547 | 0.83 | ADORA2A (0.41) | MAOBMEN1KMT2AADORA2ANPC1 | |
| SCHEMBL29096558 | 0.82 | ERN1 (0.49) | ALDH1A1GAATAAR1ERN1HPGD |
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-116693552-A | Polycyclic dihydrobenzofuran compound and preparation method thereof | 浙江大学 | 2023-09-05 | — | — | CN | disclosed |