Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | TNK2 | Q07912 | 11/20 | 0.34 |
| ▸ | CALCA | P06881 | 2/20 | 0.34 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 3/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17524873 | 0.82 | HTR6 (0.38) | HTR6CALCAEGLN1 | |
| SCHEMBL17524928 | 0.81 | HTR6 (0.37) | HTR6CALCAEGLN1 | |
| SCHEMBL17524881 | 0.79 | CRHR1 (0.33) | HTR6CALCAEGLN1 | |
| SCHEMBL17524907 | 0.75 | MALT1 (0.41) | TNK2CALCAEGLN1 | |
| SCHEMBL17525014 | 0.75 | CALCA (0.38) | CALCA | |
| SCHEMBL17524875 | 0.75 | NPC1 (0.45) | CALCA | |
| SCHEMBL17525080 | 0.74 | LRRK2 (0.39) | HTR6CALCALRRK2EGLN1 | |
| SCHEMBL17524901 | 0.74 | ADRA2B (0.40) | HTR6CALCAEGLN1 | |
| SCHEMBL17524910 | 0.74 | EGLN1 (0.43) | HTR6CALCAEGLN1 | |
| SCHEMBL17524933 | 0.73 | CALCA (0.40) | HTR6CALCAEGLN1 |
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 |