Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KISS1R | Q969F8 | 4/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | MME | P08473 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | ESRRB | O95718 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23499675 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2CA14CA12CA7CA9 | |
| SCHEMBL10296128 | 0.82 | — | — | |
| SCHEMBL17898138 | 0.82 | — | — | |
| SCHEMBL23499631 | 0.82 | SMN1; SMN2 (0.41) | SMN1; SMN2CA14CA12CA7CA9 | |
| SCHEMBL19889337 | 0.82 | SMN1; SMN2 (0.34) | SMN1; SMN2CA14CA12CA7CA9 | |
| SCHEMBL1557617 | 0.79 | SMN1; SMN2 (0.46) | SMN1; SMN2CA14CA12CA7CA9 | |
| SCHEMBL24072865 | 0.79 | SMN1; SMN2 (0.46) | SMN1; SMN2CA14CA12CA7CA9 | |
| SCHEMBL25362043 | 0.78 | CA1 (0.41) | SMN1; SMN2CA14CA12MMEALDH1A1 | |
| SCHEMBL19428351 | 0.78 | CA1 (0.41) | SMN1; SMN2CA14CA12MMEALDH1A1 | |
| SCHEMBL14865389 | 0.78 | CA1 (0.41) | SMN1; SMN2CA14CA12MMEALDH1A1 |
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-3357931-B1 | METHODS OF SYNTHESIS OF TRITERPENE PROSAPOGENINS AND TRITERPENE SAPONINS | SLOAN KETTERING INST CANCER RES (US) | 2020-07-22 | — | — | EP | disclosed |