Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.38 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | STAT6 | P42226 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28427775 | 1.00 | APLNR (0.38) | APLNRFFAR3MAPK1ALDH1A1TP53 | |
| SCHEMBL1286184 | 0.86 | TDP1 (0.35) | APLNRFFAR3MAPK1ALDH1A1TP53 | |
| SCHEMBL29259508 | 0.83 | HTT (0.33) | ALDH1A1HSD17B10HIF1ALMNAHTT | |
| SCHEMBL350106 | 0.75 | MAPK1 (0.44) | APLNRFFAR3MAPK1ALDH1A1TP53 | |
| SCHEMBL284401 | 0.75 | APLNR (0.38) | APLNRFFAR3MAPK1TP53SMN1; SMN2 | |
| SCHEMBL911204 | 0.75 | MAPK1 (0.44) | APLNRFFAR3MAPK1ALDH1A1TP53 | |
| SCHEMBL911206 | 0.75 | MAPK1 (0.44) | APLNRFFAR3MAPK1ALDH1A1TP53 | |
| SCHEMBL5246594 | 0.73 | APLNR (0.41) | APLNRFFAR3MAPK1ALDH1A1TP53 | |
| SCHEMBL11260869 | 0.73 | APLNR (0.41) | APLNRFFAR3MAPK1ALDH1A1TP53 | |
| SCHEMBL3385056 | 0.73 | APLNR (0.41) | APLNRFFAR3MAPK1ALDH1A1TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113149968-B | Compound serving as ketohexokinase inhibitor and application thereof | 博济医药科技股份有限公司 | 2024-06-04 | — | — | CN | disclosed |
| CN-114181198-A | Pyrimidine derivative ketohexokinase inhibitor and application thereof | 山东轩竹医药科技有限公司 | 2022-03-15 | — | — | CN | disclosed |
| CN-113149968-A | Compound serving as ketohexokinase inhibitor and application thereof | 广州博济医药生物技术股份有限公司 | 2021-07-23 | — | — | CN | disclosed |
| CN-111423420-A | Fused ring compounds as ketohexokinase inhibitors | 广州博济医药生物技术股份有限公司 | 2020-07-17 | — | — | CN | disclosed |