Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 7/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 5/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.32 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.32 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.32 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.32 |
| ▸ | HCAR1 | Q9BXC0 | 2/20 | 0.32 |
| ▸ | LIPE | Q05469 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5050103 | 0.81 | ENPP2 (0.39) | ENPP2LIPGORAI1ORAI2ORAI3 | |
| SCHEMBL29344091 | 0.75 | PDE2A (0.32) | ALDH1A1HTTENPP2 | |
| SCHEMBL29367623 | 0.73 | ENPP2 (0.43) | ALDH1A1HTTENPP2LIPGORAI1 | |
| SCHEMBL24389 | 0.73 | ENPP2 (0.43) | ALDH1A1HTTENPP2LIPGORAI1 | |
| SCHEMBL29788344 | 0.71 | ALDH1A1 (0.41) | ALDH1A1PKMHPGDHTTL3MBTL1 | |
| SCHEMBL3542339 | 0.71 | ALDH1A1 (0.41) | ALDH1A1PKMHPGDHTTL3MBTL1 | |
| SCHEMBL476656 | 0.71 | ACHE (0.41) | ALDH1A1PKMHPGDHTTL3MBTL1 | |
| SCHEMBL25340918 | 0.71 | SLC6A2 (0.54) | ALDH1A1ORAI1ORAI2ORAI3 | |
| Lithium Ion SCHEMBL9536158 | 0.70 | ALDH1A1 (0.37) | ALDH1A1PKMHPGDHTTL3MBTL1 | |
| Ammonia Solution, Strong SCHEMBL27817193 | 0.70 | ACHE (0.39) | ALDH1A1PKMHPGDHTTL3MBTL1 |
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 |