Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 2/20 | 0.46 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.46 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27555050 | 0.98 | SLC1A3 (0.45) | SLC1A3SLC1A2SLC1A1CYP1A2CYP2C9 | |
| SCHEMBL13170592 | 0.85 | SLC1A3 (0.49) | SLC1A3SLC1A2SLC1A1CYP1A2CYP2C9 | |
| SCHEMBL16267407 | 0.83 | CHRM5 (0.46) | CYP1A2CYP2C9CYP2C19TP53SIRT5 | |
| SCHEMBL13044441 | 0.81 | ALDH1A1 (0.55) | SLC1A3SLC1A2SLC1A1CYP1A2CYP2C9 | |
| SCHEMBL13788662 | 0.81 | SLC1A3 (0.43) | SLC1A3SLC1A2SLC1A1CYP1A2CYP2C9 | |
| SCHEMBL31453738 | 0.81 | SLC1A3 (0.43) | SLC1A3SLC1A2SLC1A1CYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL27717048 | 0.80 | ALDH1A1 (0.53) | SLC1A3SLC1A2SLC1A1CYP1A2CYP2C9 | |
| SCHEMBL14011319 | 0.79 | SLC1A3 (0.50) | SLC1A3SLC1A2SLC1A1CYP1A2CYP2C9 | |
| SCHEMBL7641621 | 0.78 | ALDH1A1 (0.52) | CYP1A2CYP2C19ALDH1A1HTTL3MBTL1 | |
| SCHEMBL13788676 | 0.78 | SLC1A3 (0.43) | SLC1A3SLC1A2SLC1A1CYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1832920-A | Aryl and heteroaryl compounds, compositions, and methods of use | TRANSTECH PHARMA INC (US) | 2006-09-13 | — | — | CN | disclosed |