Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Succinic Acid SCHEMBL27643151 | 0.86 | TSHR (0.58) | TSHRKEAP1CES2CES1NR4A2 | |
| Chlorobenzene SCHEMBL28101923 | 0.84 | FOLH1 (0.59) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| Glutarate SCHEMBL28366860 | 0.82 | ALDH1A1 (0.58) | TSHRKEAP1CES2CES1NR4A2 | |
| Toluene SCHEMBL27856861 | 0.78 | KMT2A (0.48) | TSHRKEAP1CES2CES1NR4A2 | |
| Chlorobenzene SCHEMBL28208301 | 0.78 | HDAC3 (0.56) | TSHRKEAP1CES2CES1NR4A2 | |
| Chlorobenzene SCHEMBL10442118 | 0.77 | TSHR (0.52) | TSHRCES2CES1MAPK1ALDH1A1 | |
| Mercaptopropionic Acid SCHEMBL5575773 | 0.77 | HDAC1 (0.44) | TSHRKEAP1NR4A2ACEFFAR1 | |
| Chlorobenzene SCHEMBL28030555 | 0.77 | HDAC3 (0.54) | TSHRKEAP1CES2CES1NR4A2 | |
| Chlorobenzene SCHEMBL3005502 | 0.77 | TSHR (0.58) | TSHRKEAP1CES2CES1MAPK1 | |
| Chlorobenzene SCHEMBL15240757 | 0.76 | TSHR (0.65) | TSHRCES2CES1ALDH1A1MAPT |
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-110229333-B | Synthetic method of polyimide | 湘潭大学 | 2022-02-15 | — | — | CN | disclosed |