Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1900173 | 0.85 | PTGS1 (0.55) | PTGS1AKR1C3FFAR3LCKFYN | |
| SCHEMBL2729477 | 0.85 | PTGS1 (0.55) | PTGS1AKR1C3FFAR3LCKFYN | |
| SCHEMBL3791596 | 0.85 | PTGS1 (0.55) | PTGS1AKR1C3FFAR3LCKFYN | |
| SCHEMBL1519050 | 0.83 | PTGS1 (0.44) | PTGS1AKR1C3FFAR3LCKFYN | |
| SCHEMBL10109997 | 0.80 | — | — | |
| SCHEMBL19836704 | 0.77 | PTGS1 (0.36) | PTGS1 | |
| SCHEMBL27727592 | 0.77 | PTGS1 (0.48) | PTGS1AKR1C3FFAR3LCKFYN | |
| SCHEMBL3235657 | 0.77 | PTGS1 (0.48) | PTGS1AKR1C3FFAR3LCKFYN | |
| SCHEMBL15449455 | 0.77 | PTGS1 (0.48) | PTGS1AKR1C3FFAR3LCKFYN | |
| SCHEMBL8144491 | 0.77 | PTGS1 (0.48) | PTGS1AKR1C3FFAR3LCKFYN |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012035057-A2 | PROCESS FOR DETERMINING THE SUITABILITY FOR DISTRIBUTION OF A BATCH OF A THIOPHENE-2-CARBOXAMIDE DERIVATIVE | MEDICHEM S.A. (ES) | 2012-03-22 | — | — | WO | disclosed |