Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CAMKK1 | Q8N5S9 | 2/20 | 0.33 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | GLS | O94925 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL14862766 | 0.85 | MAPK10 (0.40) | ABCC1ABCG2MAPK10HTTLMNA | |
| SCHEMBL2550311 | 0.81 | ABCC1 (0.38) | ABCC1ABCG2MAPK10HTTLMNA | |
| SCHEMBL2555585 | 0.77 | MAPK10 (0.38) | ABCC1ABCG2MAPK10HTTLMNA | |
| SCHEMBL23413476 | 0.76 | PTPN2 (0.46) | ABCC1ABCG2MAPK10LMNAALDH1A1 | |
| SCHEMBL29529418 | 0.76 | LMNA (0.36) | MAPK10HTTLMNANPC1RAB9A | |
| SCHEMBL20521813 | 0.74 | MAPT (0.52) | MAPK10HTTLMNAPTK2NPC1 | |
| SCHEMBL4556834 | 0.70 | PRNP (0.45) | ABCC1MAPK10HTTLMNAPTK2 | |
| SCHEMBL11147061 | 0.69 | PTGDR2 (0.38) | ABCC1ABCG2MAPK10HTT | |
| SCHEMBL17164879 | 0.68 | MAPT (0.44) | MAPK10HTTLMNAPTK2NPC1 | |
| Hydrochloric Acid SCHEMBL31247929 | 0.68 | PTPN2 (0.39) | ABCC1ABCG2ALDH1A1CYP2D6TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114213370-B | Method for synthesizing alkylated electron-rich heterocyclic aromatic hydrocarbon by photo-induced NHPI ester decarboxylation coupling | 中山大学 | 2023-10-27 | — | — | CN | disclosed |
| CN-114213370-A | Method for synthesizing alkylated electron-rich heterocyclic aromatic hydrocarbon by virtue of photoinduced decarboxylation coupling of NHPI ester | 中山大学 | 2022-03-22 | — | — | CN | disclosed |