Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | APAF1 | O14727 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ASPH | Q12797 | 1/20 | 0.32 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL2001737 | 0.92 | KDM4E (0.33) | KDM4EAPAF1ALDH1A1MAPTHTT | |
| SCHEMBL2003225 | 0.82 | NR3C2 (0.41) | SMN1; SMN2TDP1 | |
| SCHEMBL2001383 | 0.81 | NOS3 (0.36) | SMN1; SMN2 | |
| SCHEMBL1996165 | 0.79 | GSK3B (0.43) | KDM4EHTTSMN1; SMN2NPSR1TDP1 | |
| SCHEMBL2000744 | 0.74 | GBA1 (0.42) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL2003223 | 0.73 | NR3C2 (0.41) | SMN1; SMN2MAPK14 | |
| SCHEMBL2003485 | 0.72 | SMN1; SMN2 (0.54) | KDM4EALDH1A1MAPTHTTSMN1; SMN2 | |
| SCHEMBL1998481 | 0.72 | CDC25A (0.40) | KDM4EAPAF1ALDH1A1MAPTHTT | |
| SCHEMBL2000989 | 0.72 | CNR1 (0.38) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL1997881 | 0.72 | TOP2A (0.42) | ALDH1A1MAPTHTTSMN1; SMN2NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7960380-B2 | Non-anilinic derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators | ASTRAZENECA AB (SE) | 2011-06-14 | — | — | US | disclosed |