Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 20/20 | 0.50 |
| ▸ | RAMP1 | O60894 | 1/20 | 0.40 |
| ▸ | CALCA | P06881 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1824892 | 1.00 | CALCRL (0.50) | CALCRLRAMP1CALCA | |
| SCHEMBL3066255 | 0.86 | CALCRL (0.60) | CALCRLRAMP1CALCA | |
| SCHEMBL4559699 | 0.86 | CALCRL (0.60) | CALCRLRAMP1CALCA | |
| SCHEMBL1198319 | 0.86 | CALCRL (0.60) | CALCRLRAMP1CALCA | |
| SCHEMBL13036911 | 0.86 | CALCRL (0.60) | CALCRLRAMP1CALCA | |
| SCHEMBL13050655 | 0.86 | CALCRL (0.60) | CALCRLRAMP1CALCA | |
| Hydrochloric Acid SCHEMBL3058435 | 0.85 | CALCRL (0.59) | CALCRLRAMP1CALCA | |
| Hydrochloric Acid SCHEMBL4663029 | 0.85 | CALCRL (0.59) | CALCRLRAMP1CALCA | |
| SCHEMBL5319544 | 0.80 | CALCRL (0.59) | CALCRLRAMP1CALCA | |
| SCHEMBL1825310 | 0.80 | CALCRL (0.59) | CALCRLRAMP1CALCA |
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-1802372-A2 | CGRP RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 2007-07-04 | — | — | EP | disclosed |
| WO-2006044449-A2 | CGRP RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2006-04-27 | — | — | WO | disclosed |