Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 7/20 | 0.43 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 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 | |
|---|---|---|---|---|
| SCHEMBL29958037 | 0.82 | CDK4 (0.40) | ACACBHCAR3L3MBTL1ALDH1A1TDP1 | |
| SCHEMBL24567546 | 0.77 | MEN1 (0.45) | ACACBHCAR3L3MBTL1ALDH1A1TP53 | |
| SCHEMBL15022600 | 0.77 | RAB9A (0.45) | ACACBHCAR3L3MBTL1ALDH1A1TP53 | |
| SCHEMBL23852654 | 0.75 | TAS1R3 (0.37) | ACACBHCAR3ALDH1A1SMN1; SMN2 | |
| SCHEMBL9272660 | 0.74 | ALDH1A1 (0.48) | ACACBHCAR3L3MBTL1ALDH1A1TP53 | |
| SCHEMBL3719041 | 0.74 | HCAR3 (0.53) | ACACBHCAR3CYP1A2CYP2C19MEN1 | |
| SCHEMBL26085322 | 0.72 | DHODH (0.37) | ACACBHCAR3DHODH | |
| SCHEMBL29958007 | 0.72 | ALDH1A1 (0.41) | ACACBHCAR3L3MBTL1ALDH1A1TP53 | |
| SCHEMBL29954362 | 0.72 | ESR1 (0.44) | ACACBHCAR3ALDH1A1 | |
| SCHEMBL7040045 | 0.72 | ALDH1A1 (0.69) | HCAR3L3MBTL1ALDH1A1TP53SMN1; SMN2 |
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 |