Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | GBA1 | P04062 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 4/20 | 0.40 |
| ▸ | BCR | P11274 | 4/20 | 0.40 |
| ▸ | TACR3 | P29371 | 1/20 | 0.38 |
| ▸ | PLAUR | Q03405 | 1/20 | 0.38 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1763503 | 0.88 | CYP2C9 (0.49) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL2629049 | 0.87 | CYP2C19 (0.65) | CYP2C9CYP2C19CYP3A4CYP2D6SLC6A7 | |
| SCHEMBL2633348 | 0.87 | CYP2C19 (0.65) | CYP2C9CYP2C19CYP3A4CYP2D6SLC6A7 | |
| SCHEMBL1763035 | 0.85 | CYP2C9 (0.48) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL2629052 | 0.85 | CYP2C9 (0.49) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL1763197 | 0.84 | CYP2C9 (0.48) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL15346088 | 0.83 | CYP2C9 (0.50) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL2629034 | 0.82 | CYP2C9 (0.52) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL1763071 | 0.82 | CYP2C9 (0.49) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL1764105 | 0.82 | CYP2C9 (0.55) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1363705-B9 | COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES | BRISTOL MYERS SQUIBB CO (US) | 2012-11-07 | — | — | EP | disclosed |