Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL12812353 | 0.97 | CALCRL (0.45) | CALCRLHCRTR2 | |
| SCHEMBL12812342 | 0.86 | HCRTR2 (0.42) | CALCRLHCRTR2 | |
| SCHEMBL12812347 | 0.85 | HCRTR2 (0.41) | CALCRLHCRTR2 | |
| SCHEMBL12812345 | 0.84 | HCRTR2 (0.42) | CALCRLHCRTR2 | |
| SCHEMBL12812350 | 0.82 | HCRTR2 (0.43) | CALCRLHCRTR2 | |
| SCHEMBL12812343 | 0.81 | NAMPT (0.41) | CALCRLHCRTR2 | |
| SCHEMBL12812348 | 0.80 | HCRTR2 (0.41) | CALCRLHCRTR2 | |
| SCHEMBL12812368 | 0.78 | HCRTR2 (0.41) | CALCRLHCRTR2 | |
| SCHEMBL12812340 | 0.75 | HCRTR2 (0.39) | CALCRLHCRTR2 | |
| SCHEMBL12812351 | 0.74 | HCRTR2 (0.42) | CALCRLHCRTR2 |
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-1804919-B1 | CGRP RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME (US) | 2011-03-30 | — | — | EP | disclosed |