Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | DPP4 | P27487 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CCR3 | P51677 | 3/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4242392 | 0.84 | CHRM4 (0.49) | CYP3A4DPP4CCR3TACR1CHRM4 | |
| SCHEMBL8092993 | 0.83 | HTR2B (0.44) | ATMCCR3GRIN1GRIN2BCHRM4 | |
| SCHEMBL8094653 | 0.79 | PDE2A (0.47) | ATMCHRM4ALDH1A1 | |
| SCHEMBL8103772 | 0.76 | DPP4 (0.43) | CYP3A4DPP4ATMGRIN1GRIN2B | |
| SCHEMBL13969375 | 0.74 | HTR1D (0.42) | CYP3A4DPP4CCR3CHRM4DRD2 | |
| SCHEMBL8100848 | 0.74 | HRH3 (0.44) | CYP3A4DPP4CCR3CHRM4DRD2 | |
| SCHEMBL13945453 | 0.73 | CYP3A4 (0.47) | CYP3A4DPP4CCR3CHRM4HRH1 | |
| SCHEMBL8094629 | 0.73 | DPP4 (0.47) | CYP3A4DPP4CCR3CHRM4HRH1 | |
| SCHEMBL8098182 | 0.72 | DPP4 (0.45) | CYP3A4DPP4ATMGRIN1GRIN2B | |
| SCHEMBL4241073 | 0.71 | CHRM4 (0.42) | CYP3A4DPP4GRIN1GRIN2BCHRM4 |
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-2009000085-A1 | QUINOLINE AND QUINAZOLINE DERIVATIVES USEFUL AS MODULATORS OF GATED ION CHANNELS | PAINCEPTOR PHARMA CORPORATION (CA) | 2008-12-31 | — | — | WO | disclosed |