Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | AGXT | P21549 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18525626 | 0.89 | TSHR (0.43) | CETPTSHRALDH1A1CYP3A4MAPK1 | |
| SCHEMBL23746328 | 0.89 | ALDH1A1 (0.44) | CETPTSHRALDH1A1CYP3A4MAPK1 | |
| SCHEMBL21327698 | 0.86 | TSHR (0.48) | TSHRALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL29307029 | 0.82 | CETP (0.43) | CETPTSHRALDH1A1CYP3A4MAPK1 | |
| SCHEMBL6983502 | 0.81 | TSHR (0.43) | TSHRALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL12879586 | 0.80 | TSHR (0.46) | TSHRALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL10389226 | 0.80 | CETP (0.44) | CETPTSHRALDH1A1CYP3A4MAPK1 | |
| SCHEMBL21838058 | 0.79 | TSHR (0.41) | TSHRALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL4421706 | 0.79 | TSHR (0.41) | TSHRALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL10172958 | 0.79 | TSHR (0.42) | TSHRALDH1A1IDO1SMN1; SMN2TP53 |
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-2018019549-A1 | DIOXOLANONE INTERMEDIATE USEFUL IN THE SYNTHESIS OF HOMOHARRINGTONINE | INDENA S.P.A. (IT) | 2018-02-01 | — | — | WO | disclosed |