Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.34 |
| ▸ | DHODH | Q02127 | 2/20 | 0.33 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.33 |
| ▸ | ACLY | P53396 | 1/20 | 0.33 |
| ▸ | GCGR | P47871 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | MARS1 | P56192 | 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 | |
|---|---|---|---|---|
| SCHEMBL6526590 | 1.00 | PTGES (0.36) | PTGESPTGS1XDHBACE1CHEK1 | |
| SCHEMBL1481232 | 0.96 | PTGES (0.38) | PTGESPTGS1XDHBACE1CHEK1 | |
| SCHEMBL1481234 | 0.96 | PTGES (0.38) | PTGESPTGS1XDHBACE1CHEK1 | |
| SCHEMBL1480753 | 0.87 | TRPV1 (0.40) | TRPV1DHODHACLYMARS1 | |
| SCHEMBL1480749 | 0.87 | TRPV1 (0.40) | TRPV1DHODHACLYMARS1 | |
| SCHEMBL1481330 | 0.84 | ALDH1A3 (0.43) | XDHBACE1GCGR | |
| SCHEMBL1481332 | 0.84 | ALDH1A3 (0.43) | XDHBACE1GCGR | |
| SCHEMBL1480155 | 0.82 | DHODH (0.39) | DHODH | |
| SCHEMBL1480157 | 0.82 | DHODH (0.39) | DHODH | |
| SCHEMBL1676532 | 0.82 | DPP4 (0.43) | PTGESPTGS1XDHTRPV1 |
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-1594847-A2 | SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS | Transtech Pharma, Inc. (US) | 2005-11-16 | — | — | EP | disclosed |
| WO-2004071447-A2 | SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS | TRANSTECH PHARMA INC. (US) | 2004-08-26 | — | — | WO | disclosed |