Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALML3 | P27482 | 6/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10197541 | 0.90 | CALML3 (0.72) | CALML3CYP2C19CYP2C9MAOACYP3A4 | |
| SCHEMBL10197347 | 0.89 | CALML3 (0.61) | CALML3CYP2C19CYP2C9MAOACYP3A4 | |
| SCHEMBL18786552 | 0.87 | CALML3 (0.69) | CALML3CYP2C19CYP2C9MAOACYP3A4 | |
| SCHEMBL18786214 | 0.87 | CALML3 (0.69) | CALML3CYP2C19CYP2C9MAOACYP3A4 | |
| SCHEMBL18786420 | 0.86 | CALML3 (0.65) | CALML3CYP2C19CYP2C9MAOACYP3A4 | |
| SCHEMBL18786447 | 0.86 | CALML3 (0.65) | CALML3CYP2C19CYP2C9MAOACYP3A4 | |
| SCHEMBL11983286 | 0.85 | CALML3 (0.61) | CALML3CYP2C19CYP2C9MAOACYP3A4 | |
| SCHEMBL18786464 | 0.85 | CALML3 (0.61) | CALML3CYP2C19CYP2C9MAOACYP3A4 | |
| SCHEMBL5172878 | 0.85 | CALML3 (0.61) | CALML3CYP2C19CYP2C9MAOACYP3A4 | |
| SCHEMBL18786551 | 0.84 | CALML3 (0.63) | CALML3CYP2C19CYP2C9MAOACYP3A4 |
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-1656370-B1 | BIARYL HETEROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | RIB X PHARMACEUTICALS INC (US) | 2012-08-15 | — | — | EP | disclosed |