Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 14/20 | 0.54 |
| ▸ | APLNR | P35414 | 4/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 1/20 | 0.49 |
| ▸ | MME | P08473 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15635838 | 0.92 | CTSA (0.55) | CTSADHODHMMECYP3A4 | |
| SCHEMBL2325361 | 0.92 | CTSA (0.55) | CTSADHODHMMECYP3A4 | |
| SCHEMBL15637008 | 0.92 | CTSA (0.53) | CTSAAPLNRMMECYP3A4 | |
| SCHEMBL15637420 | 0.91 | APLNR (0.54) | CTSAAPLNRPTGS2DHODHMME | |
| SCHEMBL15636682 | 0.91 | CTSA (0.54) | CTSAAPLNRMMECYP3A4 | |
| SCHEMBL15635973 | 0.90 | CTSA (0.54) | CTSADHODH | |
| SCHEMBL15637471 | 0.90 | CTSA (0.52) | CTSAAPLNRPTGS2MMECYP3A4 | |
| SCHEMBL15636386 | 0.89 | CTSA (0.54) | CTSAAPLNR | |
| SCHEMBL16223863 | 0.89 | CTSA (0.54) | CTSAAPLNR | |
| SCHEMBL15637366 | 0.89 | CTSA (0.52) | CTSAAPLNRPTGS2 |
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-2014053533-A1 | USE OF SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AS PHARMACEUTICALS FOR PREVENTION/TREATMENT OF ATRIAL FIBRILLATION | SANOFI (FR) | 2014-04-10 | — | — | WO | disclosed |