Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.37 |
| ▸ | FAAH | O00519 | 5/20 | 0.37 |
| ▸ | CA4 | P22748 | 3/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL2005917 | 0.93 | TBXAS1 (0.36) | PTGS1NR1H2NR1H3KDM4E | |
| SCHEMBL2005055 | 0.91 | PTGS1 (0.40) | PTGS1NR1H2NR1H3MTNR1AMTNR1B | |
| SCHEMBL2000963 | 0.90 | NR1H2 (0.41) | NR1H2NR1H3MTNR1AMTNR1BPTGS2 | |
| SCHEMBL2005919 | 0.90 | TBXAS1 (0.35) | PTGS1NR1H2NR1H3KDM4E | |
| SCHEMBL2004365 | 0.86 | NR1H2 (0.43) | NR1H2NR1H3MTNR1AMTNR1BLIPG | |
| SCHEMBL2000296 | 0.86 | KMT2A (0.43) | NR1H2NR1H3LIPGSMN1; SMN2 | |
| SCHEMBL1997783 | 0.85 | NR1H2 (0.44) | NR1H2NR1H3MTNR1AMTNR1BLIPG | |
| SCHEMBL2000304 | 0.85 | NR1H2 (0.48) | NR1H2NR1H3MTNR1AMTNR1BCA12 | |
| SCHEMBL2003667 | 0.85 | ALDH1A1 (0.42) | NR1H2NR1H3MTNR1AMTNR1BLIPG | |
| SCHEMBL1998101 | 0.84 | PLA2G4B (0.41) | NR1H2NR1H3LIPGKDM4EALDH1A1 |
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 |