Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28294538 | 0.87 | TSHR (0.41) | TSHRALDH1A1SMN1; SMN2SLC7A5TDP1 | |
| SCHEMBL7268427 | 0.81 | SLC7A5 (0.46) | TSHRSLC7A5 | |
| SCHEMBL19872291 | 0.78 | TSHR (0.41) | TSHRALDH1A1SMN1; SMN2SLC7A5TDP1 | |
| SCHEMBL4761853 | 0.78 | TSHR (0.48) | TSHRALDH1A1SMN1; SMN2SLC7A5TDP1 | |
| SCHEMBL722409 | 0.78 | TSHR (0.48) | TSHRALDH1A1SMN1; SMN2SLC7A5TDP1 | |
| SCHEMBL722410 | 0.78 | TSHR (0.48) | TSHRALDH1A1SMN1; SMN2SLC7A5TDP1 | |
| Hydrochloric Acid SCHEMBL18954375 | 0.76 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2SLC7A5TDP1 | |
| SCHEMBL31110291 | 0.76 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2TDP1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL1314862 | 0.76 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2SLC7A5TDP1 | |
| Hydrochloric Acid SCHEMBL4415250 | 0.76 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2SLC7A5TDP1 |
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-2018037120-A1 | PRODRUGS ACTIVATED BY REACTIVE OXYGEN SPECIES FOR USE IN THE TREATMENT OF INFLAMMATORY DISEASES AND CANCER | DANMARKS TEKNISKE UNIVERSITET (DK) | 2018-03-01 | — | — | WO | disclosed |