Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3166241 | 0.82 | ALDH1A1 (0.44) | ALDH1A1CA12CA2CYP3A4CA9 | |
| SCHEMBL26192746 | 0.82 | ALDH1A1 (0.44) | ALDH1A1CA12CA2CYP3A4CA9 | |
| SCHEMBL29650356 | 0.82 | ALDH1A1 (0.44) | ALDH1A1CA12CA2CYP3A4CA9 | |
| SCHEMBL9806922 | 0.82 | KIF11 (0.49) | ALDH1A1CA12CA2CYP3A4CA9 | |
| SCHEMBL26192998 | 0.79 | CYP3A4 (0.50) | ALDH1A1CA12CA2CYP3A4CA9 | |
| SCHEMBL8079236 | 0.78 | CA2 (0.42) | ALDH1A1CA12CA2CYP3A4CA9 | |
| SCHEMBL19692896 | 0.77 | ALDH1A1 (0.39) | ALDH1A1CA12CA2CYP3A4CA9 | |
| SCHEMBL6659524 | 0.77 | ALDH1A1 (0.39) | ALDH1A1CA12CA2CYP3A4CA9 | |
| SCHEMBL29650290 | 0.77 | ALDH1A1 (0.39) | ALDH1A1CA12CA2CYP3A4CA9 | |
| SCHEMBL9323120 | 0.77 | MAP1LC3B (0.46) | ALDH1A1CA12CA2CYP3A4CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018140809-A1 | MODULATORS OF ESTROGEN RECEPTOR PROTEOLYSIS AND ASSOCIATED METHODS OF USE | Arvinas, Inc. (US) | 2018-08-02 | — | — | WO | disclosed |