Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.70 |
| ▸ | SCN1A | P35498 | 4/20 | 0.70 |
| ▸ | SCN2A | Q99250 | 4/20 | 0.70 |
| ▸ | SCN3A | Q9NY46 | 4/20 | 0.70 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.70 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.70 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.70 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.70 |
| ▸ | TSHR | P16473 | 2/20 | 0.70 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.70 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.70 |
| ▸ | RAD52 | P43351 | 1/20 | 0.69 |
| ▸ | MAOA | P21397 | 3/20 | 0.65 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Benoxinate SCHEMBL25087 | 0.82 | CYP2D6 (1.00) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 | |
| Benoxinate SCHEMBL30849863 | 0.82 | CYP2D6 (1.00) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 | |
| SCHEMBL9576785 | 0.82 | PHLPP2 (0.69) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 | |
| SCHEMBL13440050 | 0.81 | CYP1A2 (0.57) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 | |
| Benoxinate SCHEMBL1649661 | 0.81 | RAD52 (1.00) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 | |
| Benoxinate SCHEMBL212440 | 0.81 | RAD52 (1.00) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 | |
| SCHEMBL8085916 | 0.81 | CYP1A2 (0.73) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 | |
| SCHEMBL11949139 | 0.81 | CYP1A2 (0.57) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 | |
| Benoxinate SCHEMBL15532182 | 0.81 | CYP2D6 (0.95) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 | |
| SCHEMBL13440069 | 0.80 | CYP1A2 (0.55) | CYP1A2SCN1ASCN2ASCN3ACYP2D6 |
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 |