Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | SCN4A | P35499 | 1/20 | 0.33 |
| ▸ | MC3R | P41968 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 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 | |
|---|---|---|---|---|
| SCHEMBL7724917 | 0.85 | ALDH1A1 (0.50) | ALDH1A1HTTMAPK1MEN1FAAH | |
| SCHEMBL29951451 | 0.83 | ALDH1A1 (0.42) | ALDH1A1HTTMAPK1MEN1FAAH | |
| SCHEMBL29950896 | 0.79 | ALDH1A1 (0.35) | ALDH1A1MAPK1MEN1KMT2ATSHR | |
| SCHEMBL29952827 | 0.78 | TSHR (0.38) | ALDH1A1MAPK1MEN1FAAHKMT2A | |
| SCHEMBL29952413 | 0.78 | MCL1 (0.35) | ALDH1A1MAPK1FAAHKMT2ATSHR | |
| SCHEMBL13675173 | 0.72 | TDP1 (0.44) | ALDH1A1TSHRLMNAMAPTBLM | |
| SCHEMBL22035847 | 0.71 | MEN1 (0.44) | ALDH1A1HTTMAPK1MEN1FAAH | |
| SCHEMBL29956160 | 0.69 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL7137889 | 0.69 | MEN1 (0.52) | ALDH1A1HTTMAPK1MEN1FAAH | |
| SCHEMBL65290 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |