Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5401748 | 1.00 | SLC6A4 (0.48) | SLC6A4SLC6A3CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL5410214 | 0.80 | SLC6A4 (0.42) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL5401743 | 0.75 | HRH1 (0.46) | SLC6A4SLC6A3CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL5407582 | 0.75 | HRH1 (0.46) | SLC6A4SLC6A3CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL5413350 | 0.74 | NPC1 (0.46) | TSHR | |
| SCHEMBL5414559 | 0.74 | SMN1; SMN2 (0.47) | TSHR | |
| SCHEMBL7332031 | 0.74 | SLC6A4 (0.57) | SLC6A4SLC6A3CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL5403135 | 0.72 | MTNR1A (0.46) | CYP3A4TSHR | |
| SCHEMBL8416508 | 0.72 | SLC6A4 (0.61) | SLC6A4SLC6A3CYP3A4CYP1A2CYP2D6 | |
| Perastine SCHEMBL1506306 | 0.72 | CYP3A4 (0.83) | SLC6A4SLC6A3CYP3A4CYP1A2CYP2D6 |
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-7247645-B2 | Dihydropyridine derivatives | AJINOMOTO CO., INC. (JP) | 2007-07-24 | — | — | US | disclosed |