Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL4591472 | 0.84 | GAA (0.40) | CA1CA2CA9GAA | |
| SCHEMBL15067721 | 0.78 | KDM1A (0.33) | CA1CA2CA9 | |
| SCHEMBL3467798 | 0.78 | CA1 (0.31) | CA1CA2CA9GAA | |
| SCHEMBL15320818 | 0.78 | ANO1 (0.35) | AHR | |
| SCHEMBL27749404 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL29384228 | 0.76 | AHR (0.32) | AHR | |
| SCHEMBL21356184 | 0.76 | AHR (0.32) | AHR | |
| SCHEMBL17601428 | 0.75 | AHR (0.40) | AHRCA1CA2CA9GAA | |
| SCHEMBL17601206 | 0.71 | ERN1 (0.41) | AHRCA1CA2CA9GAA | |
| SCHEMBL6739825 | 0.71 | KDM4E (0.38) | — |
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-2019110751-A1 | TETRACYCLIC COMPOUNDS AS INHIBITORS OF G12C MUTANT RAS PROTEIN, FOR USE AS ANTI-CANCER AGENTS | ASTRAZENECA AB (SE) | 2019-06-13 | — | — | WO | disclosed |