Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.31 |
| ▸ | NQO2 | P16083 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.30 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.30 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.30 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.30 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.30 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.30 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.30 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.30 |
| ▸ | PDE2A | O00408 | 1/20 | 0.30 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6062545 | 0.83 | TUBB1 (0.39) | TAAR1CYP1A1CYP1A2CYP1B1ALDH1A1 | |
| SCHEMBL5353065 | 0.83 | TAAR1 (0.38) | TAAR1CYP1A1CYP1A2CYP1B1AMY1A | |
| SCHEMBL6062440 | 0.82 | RAPGEF4 (0.32) | — | |
| SCHEMBL6063568 | 0.82 | TUBB1 (0.30) | TUBB1 | |
| SCHEMBL5352628 | 0.82 | ACHE (0.35) | — | |
| SCHEMBL5358129 | 0.82 | TAAR1 (0.48) | TAAR1CYP1A1CYP1A2CYP1B1ALDH1A1 | |
| SCHEMBL6062858 | 0.80 | TUBB1 (0.35) | MAPTHTTTUBB1 | |
| SCHEMBL5346533 | 0.79 | TAAR1 (0.38) | TAAR1CYP1A1CYP1A2CYP1B1ALDH1A1 | |
| SCHEMBL6062526 | 0.79 | TUBB1 (0.42) | HTTTUBB1NFE2L2 | |
| SCHEMBL5363833 | 0.79 | — | — |
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-20060264320-A1 | Hydrophobization and silica for supported catalyst | RODRIGUEZ GEORGE | 2006-11-23 | — | — | US | disclosed |