Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.53 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | DRD1 | P21728 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | BLM | P54132 | 1/20 | 0.51 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL29952592 | 0.81 | BCHE (0.44) | CYP1A2CYP3A4CYP2C9SIGMAR1ALDH1A1 | |
| SCHEMBL11105252 | 0.80 | CYP1A2 (0.57) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2C8 | |
| SCHEMBL11099994 | 0.80 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2C8 | |
| SCHEMBL11101082 | 0.80 | CYP1A2 (0.57) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2C8 | |
| SCHEMBL9416630 | 0.79 | TSHR (0.57) | CYP1A2CYP3A4ALDH1A1ALOX15 | |
| SCHEMBL6566912 | 0.79 | HTR1A (0.69) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2C8 | |
| SCHEMBL11648537 | 0.78 | TAAR1 (0.61) | CYP3A4ALDH1A1ALOX15 | |
| SCHEMBL7795393 | 0.78 | CYP3A4 (0.64) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2C8 | |
| SCHEMBL16609989 | 0.77 | HTR1A (0.72) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2C8 | |
| SCHEMBL9485313 | 0.77 | HTR1A (0.72) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2C8 |
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-2007034329-A2 | COMPOUNDS AND METHODS FOR TREATMENT OF AMYLOID-BETA-PEPTIDE RELATED DISORDERS | EXONHIT THERAPEUTICS SA (FR) | 2007-03-29 | — | — | WO | disclosed |