Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.53 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KRAS | P01116 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17237288 | 0.92 | MEN1 (0.56) | ABCG2CA1CA2ABCB1MEN1 | |
| SCHEMBL17237285 | 0.92 | MEN1 (0.56) | ABCG2CA1CA2ABCB1MEN1 | |
| SCHEMBL17236659 | 0.91 | POLB (0.54) | ABCG2CA1CA2ABCB1MEN1 | |
| SCHEMBL17236661 | 0.91 | POLB (0.54) | ABCG2CA1CA2ABCB1MEN1 | |
| SCHEMBL17236623 | 0.90 | ABCG2 (0.54) | ABCG2CA1CA2ABCB1MEN1 | |
| SCHEMBL17251598 | 0.90 | CA1 (0.64) | ABCG2CA1CA2ABCB1MEN1 | |
| SCHEMBL17236621 | 0.90 | ABCG2 (0.54) | ABCG2CA1CA2ABCB1MEN1 | |
| SCHEMBL17236772 | 0.89 | KRAS (0.53) | ABCG2CA1CA2ABCB1MEN1 | |
| SCHEMBL17236774 | 0.89 | KRAS (0.53) | ABCG2CA1CA2ABCB1MEN1 | |
| SCHEMBL17237034 | 0.88 | ABCG2 (0.54) | ABCG2CA1CA2ABCB1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2942345-B1 | 3,4,5-TRIMETHOXYSTYRYLARYLAMINOPROPENONES FOR THE TREATMENT OF CANCER | COUNCIL SCIENT IND RES (IN) | 2018-03-28 | — | — | EP | disclosed |