Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | PPARG | P37231 | 15/20 | 0.50 |
| ▸ | PPARA | Q07869 | 13/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11322441 | 0.98 | CYP1A2 (0.53) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL1933913 | 0.98 | CYP1A2 (0.53) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL27388584 | 0.87 | PPARA (0.50) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL1832086 | 0.87 | PPARA (0.63) | PPARGPPARA | |
| SCHEMBL28137588 | 0.86 | CYP1A2 (0.44) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL8846721 | 0.85 | PPARG (0.62) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL31560867 | 0.85 | CYP1A2 (0.47) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL9763206 | 0.85 | PPARA (0.51) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL8935857 | 0.85 | PPARG (0.62) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL17904962 | 0.85 | PPARG (0.62) | CYP1A2GAACYP2C9PKMCYP2C19 |
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-20110180423-A1 | METHODS FOR REMOVING CONTAMINANTS FROM AQUEOUS SOLUTIONS USING PHOTOELECTROCATALYTIC OXIDIZATION | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2011-07-28 | — | — | US | disclosed |