Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 19/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | MME | P08473 | 3/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL15636383 | 0.90 | CTSA (0.63) | CTSACYP3A4MME | |
| SCHEMBL12100804 | 0.87 | CTSA (0.59) | CTSACYP3A4MME | |
| SCHEMBL12100806 | 0.87 | CTSA (0.59) | CTSACYP3A4MME | |
| SCHEMBL15635845 | 0.87 | CTSA (0.75) | CTSACYP3A4MME | |
| SCHEMBL12099983 | 0.84 | CTSA (0.77) | CTSACYP3A4MME | |
| SCHEMBL12099989 | 0.84 | CTSA (0.77) | CTSACYP3A4MME | |
| SCHEMBL15636971 | 0.83 | CTSA (0.57) | CTSACYP3A4MME | |
| SCHEMBL15636733 | 0.83 | CTSA (0.76) | CTSACYP3A4MME | |
| SCHEMBL15635879 | 0.83 | CTSA (0.72) | CTSACYP3A4MME | |
| SCHEMBL14696725 | 0.82 | CTSA (0.71) | CTSACYP3A4MME |
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-2668167-B1 | AMINO-SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS | SANOFI SA (FR) | 2014-12-17 | — | — | EP | disclosed |
| 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 |