Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | TNKS | O95271 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL370016 | 0.95 | — | — | |
| SCHEMBL27895709 | 0.92 | ALDH1A1 (0.46) | ALDH1A1TSHRMAOBCYP2A6LMNA | |
| Water SCHEMBL28150278 | 0.92 | ALDH1A1 (0.46) | ALDH1A1TSHRMAOBCYP2A6LMNA | |
| SCHEMBL28325527 | 0.85 | ALDH1A1 (0.40) | ALDH1A1TSHRMAOBCYP2A6LMNA | |
| SCHEMBL27977239 | 0.85 | ALDH1A1 (0.40) | ALDH1A1TSHRMAOBCYP2A6LMNA | |
| SCHEMBL28959768 | 0.81 | ALDH1A1 (0.48) | ALDH1A1TSHRMAOBCYP2A6LMNA | |
| Styrene SCHEMBL28863663 | 0.81 | ALDH1A1 (0.61) | ALDH1A1TSHRMAOBCYP2A6LMNA | |
| Nitrous Acid SCHEMBL27847130 | 0.81 | ALDH1A1 (0.37) | ALDH1A1TSHRCYP2A6LMNAL3MBTL1 | |
| SCHEMBL28015427 | 0.80 | ALDH1A1 (0.43) | ALDH1A1TSHRLMNAL3MBTL1MAPK1 | |
| Acetic Acid SCHEMBL27594704 | 0.77 | AKR1C3 (0.42) | ALDH1A1TSHRLMNAMAPTHDAC3 |
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-110256623-A | Perfluoroalkyl tetrafluoro sulphur methylene styrol copolymer and its application | 苏州大学 | 2019-09-20 | — | — | CN | disclosed |