Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4495716 | 0.92 | CALCRL (0.36) | CALCRLDGAT1 | |
| SCHEMBL4504073 | 0.77 | CALCRL (0.34) | CALCRLDGAT1 | |
| SCHEMBL4507754 | 0.77 | CALCRL (0.68) | CALCRL | |
| SCHEMBL4507707 | 0.77 | KDM4C (0.33) | CALCRL | |
| SCHEMBL4497082 | 0.76 | CALCRL (0.32) | CALCRLDGAT1 | |
| SCHEMBL4517790 | 0.75 | KDM4E (0.31) | — | |
| SCHEMBL4506911 | 0.74 | — | — | |
| SCHEMBL13203919 | 0.74 | F11 (0.32) | DGAT1 | |
| SCHEMBL2980926 | 0.74 | F11 (0.32) | DGAT1 | |
| SCHEMBL4499563 | 0.74 | BCDIN3D (0.31) | CALCRL |
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 |
|---|---|---|---|---|---|---|---|
| US-7569578-B2 | Heterocyclic anti-migraine agents | BRISTOL-MEYERS SQUIBB COMPANY (US) | 2009-08-04 | — | — | US | disclosed |