Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RAD52 | P43351 | 1/20 | 0.44 |
| ▸ | CALCA | P06881 | 4/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 8/20 | 0.37 |
| ▸ | HTR7 | P34969 | 3/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.36 |
| ▸ | CALCB | P10092 | 1/20 | 0.35 |
| ▸ | ADM2 | Q7Z4H4 | 1/20 | 0.35 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.35 |
| ▸ | CALCRL | Q16602 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17524910 | 0.91 | EGLN1 (0.43) | CALCAEGLN1HTR7HTR1AHTR2A | |
| SCHEMBL17525077 | 0.87 | HTR7 (0.46) | CALCAHTR7HTR1AHTR2AHTR6 | |
| SCHEMBL17524938 | 0.87 | HTR7 (0.45) | CALCAHTR7HTR1AHTR2AHTR6 | |
| SCHEMBL17524940 | 0.87 | CALCA (0.40) | CALCAHTR7HTR1AHTR2AHTR6 | |
| SCHEMBL17524933 | 0.86 | CALCA (0.40) | CALCAEGLN1HTR7HTR1AHTR2A | |
| SCHEMBL17524994 | 0.86 | CALCRL (0.40) | CALCAEGLN1HTR7HTR1AHTR2A | |
| SCHEMBL17524942 | 0.84 | ADRA2B (0.40) | CALCAEGLN1HTR7HTR1AHTR2A | |
| SCHEMBL17524907 | 0.84 | MALT1 (0.41) | CALCAEGLN1MALT1CALCRL | |
| SCHEMBL17524923 | 0.83 | CALCA (0.41) | GAARAD52CALCAHTR7HTR1A | |
| SCHEMBL17524997 | 0.83 | EGLN1 (0.43) | CALCAEGLN1HTR7HTR1AHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016022644-A1 | HETEROCYCLIC CGRP RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2016-02-11 | — | — | WO | disclosed |