Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCA | P06881 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CALCRL | Q16602 | 17/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 16/20 | 0.48 |
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 | 0.84 | CALCA (0.50) | CALCACALCRLCYP3A4 | |
| SCHEMBL18324451 | 0.82 | CALCA (0.49) | CALCAGAACALCRLCYP3A4 | |
| SCHEMBL3282021 | 0.80 | CALCA (0.60) | CALCACALCRLCYP3A4 | |
| SCHEMBL3595749 | 0.78 | CALCA (0.58) | CALCACALCRLCYP3A4 | |
| SCHEMBL3607821 | 0.78 | CALCRL (0.76) | CALCACALCRLCYP3A4 | |
| SCHEMBL3607815 | 0.78 | CALCRL (0.76) | CALCACALCRLCYP3A4 | |
| SCHEMBL3587479 | 0.77 | CALCRL (0.60) | CALCACALCRLCYP3A4 | |
| SCHEMBL3591393 | 0.77 | CALCA (0.57) | CALCACALCRLCYP3A4 | |
| SCHEMBL3587476 | 0.77 | CALCRL (0.60) | CALCACALCRLCYP3A4 | |
| SCHEMBL3597734 | 0.77 | CALCA (0.55) | CALCAGAACALCRLCYP3A4 |
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 |