Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 18/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 11/20 | 0.57 |
| ▸ | CALCA | P06881 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3595869 | 0.91 | CALCRL (0.54) | CALCRLCYP3A4CALCA | |
| SCHEMBL3601804 | 0.85 | CALCRL (0.53) | CALCRLCYP3A4CALCA | |
| SCHEMBL3601800 | 0.85 | CALCRL (0.53) | CALCRLCYP3A4CALCA | |
| SCHEMBL3607821 | 0.84 | CALCRL (0.76) | CALCRLCYP3A4CALCA | |
| SCHEMBL3607815 | 0.84 | CALCRL (0.76) | CALCRLCYP3A4CALCA | |
| SCHEMBL3591393 | 0.83 | CALCA (0.57) | CALCRLCYP3A4CALCA | |
| SCHEMBL3282021 | 0.83 | CALCA (0.60) | CALCRLCYP3A4CALCA | |
| SCHEMBL3597734 | 0.83 | CALCA (0.55) | CALCRLCYP3A4CALCA | |
| SCHEMBL3587479 | 0.82 | CALCRL (0.60) | CALCRLCYP3A4CALCA | |
| SCHEMBL3587476 | 0.82 | CALCRL (0.60) | CALCRLCYP3A4CALCA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100558728-C | Calcitonin gene related peptide receptor antagonists | BRISTOL MYERS SQUIBB CO (US) | 2009-11-11 | — | — | CN | disclosed |
| EP-1689493-A4 | CALCITONIN GENE RELATED PEPTIDE RECEPTOR ANTAGONISTS | BRISTOL MYERS SQUIBB CO (US) | 2008-04-23 | — | — | EP | disclosed |
| EP-1689493-A1 | CALCITONIN GENE RELATED PEPTIDE RECEPTOR ANTAGONISTS | Bristol-Myers Squibb Pharma Company (US) | 2006-08-16 | — | — | EP | disclosed |
| CN-1671711-A | Calcitonin gene related peptide receptor antagonists | BRISTOL MYERS SQUIBB CO (US) | 2005-09-21 | — | — | CN | disclosed |
| WO-2005065779-A1 | CALCITONIN GENE RELATED PEPTIDE RECEPTOR ANTAGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-07-21 | — | — | WO | disclosed |