Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 6/20 | 0.42 |
| ▸ | CALCRL | Q16602 | 5/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12812347 | 0.91 | HCRTR2 (0.41) | HCRTR2CALCRLTP53 | |
| SCHEMBL12812343 | 0.89 | NAMPT (0.41) | HCRTR2CALCRL | |
| SCHEMBL12812352 | 0.86 | CALCRL (0.46) | HCRTR2CALCRL | |
| SCHEMBL5553751 | 0.86 | CALCRL (0.41) | HCRTR2CALCRLHPGDNOTUM | |
| SCHEMBL12812353 | 0.85 | CALCRL (0.45) | HCRTR2CALCRL | |
| SCHEMBL12812368 | 0.84 | HCRTR2 (0.41) | HCRTR2CALCRLTP53 | |
| SCHEMBL12812345 | 0.83 | HCRTR2 (0.42) | HCRTR2CALCRL | |
| SCHEMBL12812348 | 0.83 | HCRTR2 (0.41) | HCRTR2CALCRLTP53 | |
| SCHEMBL12812350 | 0.81 | HCRTR2 (0.43) | HCRTR2CALCRL | |
| SCHEMBL12812340 | 0.80 | HCRTR2 (0.39) | HCRTR2CALCRLTP53 |
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 |