Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | RAF1 | P04049 | 5/20 | 0.30 |
| ▸ | BRAF | P15056 | 5/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21601360 | 0.91 | RAB9A (0.31) | SCN9AMEN1KMT2A | |
| SCHEMBL21601401 | 0.86 | KCNH2 (0.32) | — | |
| SCHEMBL21601348 | 0.81 | S1PR4 (0.35) | S1PR4MGLLPPARGDHFRSCN5A | |
| SCHEMBL21596000 | 0.76 | KCNH2 (0.52) | PPARGRAF1BRAF | |
| SCHEMBL21595956 | 0.71 | KCNH2 (0.48) | SCN9ARAF1BRAF | |
| SCHEMBL21601154 | 0.70 | CYP2C9 (0.36) | S1PR4PPARGSCN9AS1PR1RAF1 | |
| SCHEMBL21601363 | 0.70 | SCN9A (0.36) | PPARGSCN5ASCN9AMEN1KMT2A | |
| SCHEMBL21601362 | 0.69 | PTGDR2 (0.37) | S1PR4MGLLPPARGDHFRALDH1A1 | |
| SCHEMBL21601407 | 0.67 | HTR1A (0.34) | POLBSCN9ARAF1BRAF | |
| SCHEMBL20372324 | 0.66 | KCNH2 (0.47) | ALDH1A1RAF1BRAF |
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 |