Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20372152 | 0.88 | PIK3CA (0.32) | KCNH2 | |
| SCHEMBL21601140 | 0.81 | KCNH2 (0.34) | KCNH2 | |
| SCHEMBL20372314 | 0.81 | KCNH2 (0.37) | KCNH2 | |
| SCHEMBL21601348 | 0.80 | S1PR4 (0.35) | KCNH2 | |
| SCHEMBL21601250 | 0.80 | KCNH2 (0.48) | KCNH2 | |
| SCHEMBL21601407 | 0.79 | HTR1A (0.34) | — | |
| SCHEMBL20372153 | 0.78 | FFAR4 (0.38) | KCNH2 | |
| SCHEMBL20372055 | 0.78 | FFAR4 (0.42) | KCNH2 | |
| SCHEMBL21601226 | 0.77 | FFAR4 (0.35) | KCNH2 | |
| SCHEMBL21601193 | 0.76 | HDAC4 (0.35) | KCNH2 |
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-2019244066-A2 | PYRIDIN-3-YL ACETIC ACID DERIVATIVES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV Healthcare UK (No.5) Limited (GB) | 2019-12-26 | — | — | WO | disclosed |