Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | EIF4EBP1 | Q13541 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 2/20 | 0.33 |
| ▸ | PPARD | Q03181 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL21601363 | 0.95 | SCN9A (0.36) | CYP2C9PTGER1EIF4EBP1SCN9APTGDR2 | |
| SCHEMBL20372553 | 0.88 | KCNH2 (0.42) | CYP2C9PTGER1SCN9APTGDR2KCNH2 | |
| SCHEMBL21601175 | 0.86 | KCNH2 (0.39) | PTGDR2KCNH2FFAR4GRIN2BRAF1 | |
| SCHEMBL20372538 | 0.86 | KCNH2 (0.38) | CYP2C9PTGER1SCN9APTGDR2LMNA | |
| SCHEMBL20372055 | 0.86 | FFAR4 (0.42) | KCNH2FFAR4RAF1BRAF | |
| SCHEMBL20372123 | 0.85 | KCNH2 (0.40) | CYP2C9PTGER1SCN9APTGDR2KCNH2 | |
| SCHEMBL21601226 | 0.85 | FFAR4 (0.35) | KCNH2FFAR4GRIN2BRAF1BRAF | |
| SCHEMBL20372542 | 0.85 | KCNH2 (0.36) | SCN9AS1PR1KCNH2FFAR4GRIN2B | |
| SCHEMBL21601404 | 0.85 | KCNH2 (0.39) | SCN9AKCNH2FFAR4RAF1BRAF | |
| SCHEMBL21601270 | 0.85 | KCNH2 (0.38) | KCNH2FFAR4RAF1BRAF |
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 |