Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 5/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | GHSR | Q92847 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RBP4 | P02753 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 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 | |
|---|---|---|---|---|
| SCHEMBL9942600 | 1.00 | CYP2C19 (0.59) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL9942592 | 0.91 | CYP2C19 (0.59) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL1763486 | 0.90 | CYP2C19 (0.58) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL2633365 | 0.90 | CYP2C19 (0.58) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL1763427 | 0.90 | CYP2C19 (0.58) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL9942598 | 0.89 | CYP2C19 (0.71) | CYP2C19CYP2D6CYP2C9CYP3A4L3MBTL1 | |
| SCHEMBL9942597 | 0.84 | CYP2C19 (0.51) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL1763586 | 0.84 | CYP2C19 (0.50) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL1762986 | 0.84 | CYP2C19 (0.50) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL2633386 | 0.84 | CYP2C19 (0.50) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 |
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 |