Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 6/20 | 0.57 |
| ▸ | CA1 | P00915 | 4/20 | 0.57 |
| ▸ | CA2 | P00918 | 4/20 | 0.57 |
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.48 |
| ▸ | CXCL12 | P48061 | 2/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.43 |
| ▸ | TUBB | P07437 | 1/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.43 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17236655 | 0.94 | KRAS (0.65) | KRASCA1CA2TUBB1ALDH1A1 | |
| SCHEMBL17236657 | 0.94 | KRAS (0.65) | KRASCA1CA2TUBB1ALDH1A1 | |
| SCHEMBL17237414 | 0.91 | KRAS (0.66) | KRASCA1CA2TUBB1ALDH1A1 | |
| SCHEMBL17237417 | 0.91 | KRAS (0.66) | KRASCA1CA2TUBB1ALDH1A1 | |
| SCHEMBL17236677 | 0.87 | KRAS (0.57) | KRASCA1CA2TUBB1ALDH1A1 | |
| SCHEMBL17236676 | 0.87 | KRAS (0.57) | KRASCA1CA2TUBB1ALDH1A1 | |
| SCHEMBL17236643 | 0.87 | KRAS (0.72) | KRASCA1CA2ALDH1A1ATM | |
| SCHEMBL17236645 | 0.87 | KRAS (0.72) | KRASCA1CA2ALDH1A1ATM | |
| SCHEMBL17237199 | 0.86 | KRAS (0.67) | KRASCA1CA2TUBB1ALDH1A1 | |
| SCHEMBL17237203 | 0.86 | KRAS (0.67) | KRASCA1CA2TUBB1ALDH1A1 |
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 |