Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.80 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.80 |
| ▸ | SCN1A | P35498 | 4/20 | 0.80 |
| ▸ | SCN2A | Q99250 | 4/20 | 0.80 |
| ▸ | SCN3A | Q9NY46 | 4/20 | 0.80 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.52 |
| ▸ | MAOA | P21397 | 4/20 | 0.52 |
| ▸ | HTR3A | P46098 | 2/20 | 0.52 |
| ▸ | HTR2C | P28335 | 2/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.52 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14304169 | 0.95 | CYP1A2 (0.72) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| SCHEMBL22987103 | 0.89 | CYP1A2 (0.78) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| Propoxycaine SCHEMBL29353209 | 0.89 | SCN1A (1.00) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| Propoxycaine SCHEMBL83073 | 0.89 | SCN1A (1.00) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| Propoxycaine SCHEMBL24720 | 0.88 | SCN1A (0.98) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| Propoxycaine SCHEMBL1651061 | 0.86 | SCN1A (0.95) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| SCHEMBL5925544 | 0.85 | CYP1A2 (0.72) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| SCHEMBL10246464 | 0.84 | CYP1A2 (0.70) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| Ambucaine SCHEMBL82280 | 0.84 | SCN1A (0.91) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| Ambucaine SCHEMBL1007224 | 0.82 | CYP2D6 (0.88) | CYP1A2CYP2D6SCN1ASCN2ASCN3A |
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-2008011539-A2 | ANESTHETIC COMPOUNDS | PHARMACOFORE, INC. (US) | 2008-01-24 | — | — | WO | disclosed |