Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL3334615 | 0.86 | CYP2A6 (0.57) | TAAR1HTR2ACYP2A6IDO1CYP3A4 | |
| SCHEMBL5491719 | 0.86 | CYP3A4 (0.50) | APPIDO1CYP3A4 | |
| SCHEMBL24146 | 0.83 | — | — | |
| SCHEMBL455656 | 0.83 | CYP2A6 (0.61) | APPTAAR1HTR2ACYP2A6 | |
| SCHEMBL8068361 | 0.83 | CYP2A6 (0.61) | APPTAAR1HTR2ACYP2A6 | |
| SCHEMBL15026028 | 0.80 | APP (0.53) | APPTAAR1HTR2A | |
| SCHEMBL668783 | 0.78 | APP (0.68) | APPIDO1CYP3A4 | |
| SCHEMBL9305877 | 0.78 | CYP3A4 (0.44) | APPIDO1CYP3A4HRH3 | |
| SCHEMBL16848643 | 0.78 | CYP3A4 (0.44) | APPIDO1CYP3A4HRH3 | |
| Fluoride SCHEMBL5504537 | 0.77 | CYP2A6 (0.53) | APPTAAR1HTR2ACYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6034206-A | POLYANILINES; HEAT, CHEMICAL AND SOLVENT RESISTANCE | TOSOH CORPORATION (JP) | 2000-03-07 | — | — | US | disclosed |