Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | AVPR1B | P47901 | 4/20 | 0.35 |
| ▸ | TACR2 | P21452 | 3/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3487297 | 0.88 | NR1H2 (0.46) | NR1H2NR1H3MAPTCHRM4SMN1; SMN2 | |
| SCHEMBL5606492 | 0.86 | NR1H2 (0.45) | NR1H2NR1H3MAPTHTR1ADRD2 | |
| SCHEMBL3487302 | 0.86 | NR1H2 (0.43) | NR1H2NR1H3MAPTHTR1ADRD2 | |
| SCHEMBL3487898 | 0.85 | P2RX3 (0.35) | NR1H2NR1H3MAPTSMN1; SMN2KDM4E | |
| SCHEMBL5607249 | 0.84 | NR1H2 (0.43) | NR1H2NR1H3MAPTHTR1ADRD2 | |
| SCHEMBL3487580 | 0.81 | NR1H2 (0.54) | NR1H2NR1H3MAPTDRD2SMN1; SMN2 | |
| SCHEMBL5322871 | 0.81 | MAPT (0.40) | NR1H2NR1H3MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL3488288 | 0.81 | CA12 (0.41) | NR1H2NR1H3MAPTSMN1; SMN2NPC1 | |
| SCHEMBL3487222 | 0.78 | NR1H2 (0.44) | NR1H2NR1H3MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL5613809 | 0.77 | MTOR (0.38) | NR1H2NR1H3MAPTALDH1A1 |
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-1838686-A1 | DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATORS | AstraZeneca AB (SE) | 2007-10-03 | — | — | EP | disclosed |
| WO-2006073363-A1 | DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATORS | ASTRAZENECA AB (SE) | 2006-07-13 | — | — | WO | disclosed |