Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | SSTR2 | P30874 | 5/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | MERTK | Q12866 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 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 | |
|---|---|---|---|---|
| SCHEMBL5729709 | 0.83 | CHEK2 (0.44) | CHEK1SSTR2CHEK2PTGS2 | |
| SCHEMBL5730047 | 0.83 | CHEK2 (0.44) | CHEK1SSTR2CHEK2PTGS2 | |
| SCHEMBL6394083 | 0.83 | PTGS2 (0.47) | CHEK1CHEK2PTGS2MERTKPTGS1 | |
| SCHEMBL5729300 | 0.83 | PTGS2 (0.47) | CHEK1CHEK2PTGS2MERTKPTGS1 | |
| SCHEMBL7662650 | 0.79 | CHEK2 (0.42) | CHEK1SSTR2CHEK2PTGS2AURKB | |
| SCHEMBL5729507 | 0.79 | CHEK2 (0.46) | CHEK1SSTR2CHEK2PTGS2 | |
| SCHEMBL5729625 | 0.79 | CHEK2 (0.46) | CHEK1SSTR2CHEK2PTGS2 | |
| SCHEMBL5729577 | 0.79 | CHEK1 (0.42) | CHEK1SSTR2CHEK2PTGS2CHRNB4 | |
| Hydrochloric Acid SCHEMBL6311273 | 0.79 | CHEK1 (0.42) | CHEK1SSTR2CHEK2PTGS2CHRNB4 | |
| SCHEMBL5729040 | 0.75 | CHEK2 (0.48) | CHEK1SSTR2CHEK2PTGS2MERTK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1102755-B1 | SUBSTITUTED ISOXAZOLE DERIVATIVES AS ESTROGEN RECEPTOR MODULATORS | CHIRON CORP (US) | 2006-01-04 | — | — | EP | claimed |