Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCA | P06881 | 1/20 | 0.49 |
| ▸ | CALCRL | Q16602 | 17/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 12/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18324498 | 0.85 | CALCA (0.50) | CALCACALCRLCYP3A4 | |
| SCHEMBL3593267 | 0.83 | CALCRL (0.52) | CALCACALCRLCYP3A4 | |
| SCHEMBL3609080 | 0.83 | CALCRL (0.54) | CALCACALCRLCYP3A4 | |
| SCHEMBL3609084 | 0.83 | CALCRL (0.54) | CALCACALCRLCYP3A4 | |
| SCHEMBL3601804 | 0.83 | CALCRL (0.53) | CALCACALCRLCYP3A4 | |
| SCHEMBL3601800 | 0.83 | CALCRL (0.53) | CALCACALCRLCYP3A4 | |
| SCHEMBL18324497 | 0.82 | CALCA (0.52) | CALCACALCRLCYP3A4GAA | |
| SCHEMBL3606498 | 0.81 | CALCRL (0.53) | CALCACALCRLCYP3A4 | |
| SCHEMBL3606492 | 0.81 | CALCRL (0.53) | CALCACALCRLCYP3A4 | |
| SCHEMBL3601477 | 0.81 | CALCRL (0.54) | CALCACALCRLCYP3A4 |
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-1539766-B1 | CALCITONIN GENE RELATED PEPTIDE RECEPTOR ANTAGONISTS | BRISTOL MYERS SQUIBB CO (US) | 2016-12-21 | — | — | EP | disclosed |