Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.49 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.49 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.49 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.49 |
| ▸ | ALPI | P09923 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | XIAP | P98170 | 1/20 | 0.48 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CPA1 | P15085 | 3/20 | 0.46 |
| ▸ | CPA3 | P15088 | 2/20 | 0.46 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.46 |
| ▸ | CPB1 | P15086 | 1/20 | 0.46 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL157789 | 0.94 | CYP1A2 (0.57) | CYP1A2SLC1A3SLC1A2SLC1A1ALPI | |
| SCHEMBL2466759 | 0.94 | CYP1A2 (0.57) | CYP1A2SLC1A3SLC1A2SLC1A1ALPI | |
| SCHEMBL157788 | 0.94 | CYP1A2 (0.57) | CYP1A2SLC1A3SLC1A2SLC1A1ALPI | |
| Ammonia Solution, Strong SCHEMBL8346946 | 0.92 | CYP1A2 (0.55) | CYP1A2ADAMTS5SLC1A3SLC1A2SLC1A1 | |
| Water SCHEMBL28204086 | 0.92 | CYP1A2 (0.55) | CYP1A2ADAMTS5SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL27996592 | 0.92 | CYP1A2 (0.55) | CYP1A2ADAMTS5SLC1A3SLC1A2SLC1A1 | |
| Diphenylmethane SCHEMBL27627447 | 0.89 | CYP1A2 (0.52) | CYP1A2SLC1A3SLC1A2SLC1A1ALPI | |
| Phosphoric Acid SCHEMBL28045535 | 0.87 | CYP1A2 (0.50) | CYP1A2SLC1A3SLC1A2SLC1A1ALPI | |
| Phenol SCHEMBL27420281 | 0.87 | CYP1A2 (0.50) | CYP1A2ADAMTS5SLC1A3SLC1A2SLC1A1 | |
| Methacrylic Acid SCHEMBL27879874 | 0.86 | ALPI (0.47) | CYP1A2ADAMTS5SLC1A3SLC1A2SLC1A1 |
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-102274517-B | The method for treating Parkinson's disease | 纽朗制药公司 | 2018-08-31 | — | — | CN | disclosed |