Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | BCL2 | P10415 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Imidazole SCHEMBL9730626 | 0.83 | TSHR (0.42) | TSHRALDH1A1FKBP5CYP2D6CYP2C19 | |
| SCHEMBL9365256 | 0.81 | TSHR (0.52) | TSHRALDH1A1CYP2D6CYP2C19CYP1A2 | |
| SCHEMBL9621815 | 0.80 | TSHR (0.45) | TSHRALDH1A1CYP2D6CYP2C19CYP1A2 | |
| SCHEMBL9622294 | 0.76 | ALDH1A1 (0.47) | ALDH1A1CYP2C19CYP1A2CYP2C9CYP3A4 | |
| Benzyl Alcohol SCHEMBL28129833 | 0.71 | TSHR (0.47) | TSHRALDH1A1FKBP5CYP2C19CYP1A2 | |
| Diphenylmethane SCHEMBL28812103 | 0.71 | ALDH1A1 (0.43) | TSHRALDH1A1FKBP5CYP2D6CYP1A2 | |
| Phthalic Acid SCHEMBL2196833 | 0.70 | ALDH1A1 (0.54) | TSHRALDH1A1FKBP5CYP3A4MAPT | |
| Benzyl Bromide SCHEMBL16237305 | 0.70 | ALDH1A1 (0.54) | TSHRALDH1A1FKBP5CYP2D6CYP2C19 | |
| Phthalic Acid SCHEMBL2196835 | 0.70 | ALDH1A1 (0.54) | TSHRALDH1A1FKBP5CYP3A4MAPT | |
| (Chloromethyl)Benzene SCHEMBL16237519 | 0.70 | ALDH1A1 (0.50) | TSHRALDH1A1FKBP5CYP2D6CYP1A2 |
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-5114954-A | ANTIINFLAMMATORY BENZYLSELENOBENZAMIDES FROM AMINOPYRIDINES AND PICOLYLAMINES | A. NATTERMANN & CIE. GMBH (DE) | 1992-05-19 | — | — | US | disclosed |