Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1G | O43497 | 4/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | CTSC | P53634 | 4/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | MMP9 | P14780 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4598377 | 0.85 | TAAR1 (0.40) | CACNA1GCACNA1HCACNA1BCTSCHSD17B10 | |
| SCHEMBL4824959 | 0.85 | TAAR1 (0.40) | CACNA1GCACNA1HCACNA1BCTSCHSD17B10 | |
| SCHEMBL21253759 | 0.81 | MC4R (0.39) | CACNA1GCACNA1HCACNA1BCTSCHSD17B10 | |
| SCHEMBL4598385 | 0.81 | TAAR1 (0.40) | CACNA1GCACNA1HCACNA1BCTSCHSD17B10 | |
| SCHEMBL4826158 | 0.79 | CTSB (0.37) | CACNA1GCACNA1HCACNA1BCTSBCTSS | |
| SCHEMBL4819330 | 0.79 | CACNA1G (0.37) | CACNA1GCACNA1HCACNA1BCTSBCTSS | |
| SCHEMBL5262811 | 0.78 | CTSK (0.62) | CTSBCTSSCTSK | |
| SCHEMBL18942588 | 0.78 | CACNA1G (0.44) | CACNA1GCACNA1HCACNA1BCTSBCTSS | |
| SCHEMBL14842652 | 0.78 | CACNA1G (0.44) | CACNA1GCACNA1HCACNA1BCTSBCTSS | |
| SCHEMBL14842648 | 0.78 | CACNA1G (0.44) | CACNA1GCACNA1HCACNA1BCTSBCTSS |
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-2004106285-A1 | BENZAMIDE NITRILE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2004-12-09 | — | — | WO | disclosed |