Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 15/20 | 0.39 |
| ▸ | RAMP1 | O60894 | 6/20 | 0.39 |
| ▸ | ADM2 | Q7Z4H4 | 3/20 | 0.38 |
| ▸ | CALCA | P06881 | 1/20 | 0.37 |
| ▸ | CALCB | P10092 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL2895570 | 0.83 | CALCA (0.38) | CALCRLRAMP1ADM2CALCACALCB | |
| SCHEMBL2774653 | 0.73 | ADM2 (0.40) | CALCRLRAMP1ADM2CALCB | |
| SCHEMBL1815456 | 0.72 | CALCRL (0.51) | CALCRLRAMP1ADM2CALCACALCB | |
| SCHEMBL7030609 | 0.72 | CALCRL (0.51) | CALCRLRAMP1ADM2CALCACALCB | |
| SCHEMBL2097358 | 0.72 | CALCA (0.39) | CALCRLRAMP1ADM2CALCACALCB | |
| SCHEMBL29996226 | 0.72 | CALCRL (0.51) | CALCRLRAMP1ADM2CALCACALCB | |
| SCHEMBL15387275 | 0.71 | CALCA (0.37) | CALCRLRAMP1ADM2CALCACALCB | |
| SCHEMBL10246001 | 0.71 | CALCRL (0.51) | CALCRLRAMP1ADM2CALCACALCB | |
| SCHEMBL836905 | 0.71 | CALCRL (0.49) | CALCRLRAMP1ADM2CALCACALCB | |
| SCHEMBL30637945 | 0.71 | CALCRL (0.45) | CALCRLRAMP1ADM2CALCACALCB |
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-2654423-B1 | FUSED HETEROCYCLIC AZAINDANE CARBOXAMIDE CGRP RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME (US) | 2016-12-07 | — | — | EP | disclosed |