Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
| ▸ | ADH1B | P00325 | 3/20 | 0.37 |
| ▸ | ADH1C | P00326 | 3/20 | 0.37 |
| ▸ | ADH1A | P07327 | 3/20 | 0.37 |
| ▸ | ADH7 | P40394 | 3/20 | 0.37 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.35 |
| ▸ | ADH4 | P08319 | 2/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.35 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27963292 | 1.00 | TSHR (0.48) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL28014265 | 0.82 | LCK (0.48) | TSHRZDHHC7LCKPPARDZDHHC20 | |
| SCHEMBL28093040 | 0.82 | LCK (0.48) | TSHRZDHHC7LCKPPARDZDHHC20 | |
| SCHEMBL28038175 | 0.82 | LCK (0.48) | TSHRZDHHC7LCKPPARDZDHHC20 | |
| SCHEMBL28038177 | 0.82 | LCK (0.48) | TSHRZDHHC7LCKPPARDZDHHC20 | |
| SCHEMBL28037819 | 0.82 | LCK (0.48) | TSHRZDHHC7LCKPPARDZDHHC20 | |
| SCHEMBL27632771 | 0.82 | LCK (0.48) | TSHRZDHHC7LCKPPARDZDHHC20 | |
| SCHEMBL20071486 | 0.81 | TSHR (0.50) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL27842760 | 0.79 | — | — | |
| Trimethylammonium SCHEMBL28055320 | 0.78 | LCK (0.45) | TSHRZDHHC7LCKPPARDZDHHC20 |
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-105377265-A | Compositions and methods for treating conditions that affect epidermis | GENCIA CORP | 2016-03-02 | — | — | CN | disclosed |