Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 6/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 6/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.34 |
| ▸ | BMI1 | P35226 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3488288 | 0.94 | CA12 (0.41) | MAPTSMN1; SMN2NR1H2NR1H3CA12 | |
| SCHEMBL3487898 | 0.89 | P2RX3 (0.35) | MAPTSMN1; SMN2NR1H2NR1H3CA12 | |
| SCHEMBL3487340 | 0.89 | P2RX3 (0.41) | MAPTSMN1; SMN2NR1H2NR1H3CA12 | |
| SCHEMBL5614095 | 0.89 | MAPT (0.52) | MAPTSMN1; SMN2NR1H2NR1H3CA12 | |
| SCHEMBL4217757 | 0.85 | LMNA (0.39) | MAPTSMN1; SMN2NR1H2NR1H3CA12 | |
| SCHEMBL5613963 | 0.84 | NR1H2 (0.36) | MAPTSMN1; SMN2NR1H2NR1H3ALDH1A1 | |
| SCHEMBL3487831 | 0.82 | NR1H2 (0.41) | MAPTSMN1; SMN2NR1H2NR1H3ALDH1A1 | |
| SCHEMBL3488399 | 0.82 | NR1H2 (0.55) | MAPTSMN1; SMN2NR1H2NR1H3CA12 | |
| SCHEMBL1997883 | 0.82 | CA12 (0.39) | MAPTSMN1; SMN2CA12CA9ALDH1A1 | |
| SCHEMBL3487222 | 0.81 | NR1H2 (0.44) | MAPTSMN1; SMN2NR1H2NR1H3ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1838685-A1 | DERIVATIVES OF ISOTHIAZOL-3 (2H)-THIONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATORS | AstraZeneca AB (SE) | 2007-10-03 | — | — | EP | disclosed |
| WO-2006073364-A1 | DERIVATIVES OF ISOTHIAZOL-3 (2H)-THIONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATORS | ASTRAZENECA AB (SE) | 2006-07-13 | — | — | WO | disclosed |