Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 6/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 4/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.36 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 5/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29661946 | 1.00 | GRM2 (0.47) | GRM2CYP1A2ALDH1A1KDM4ETSHR | |
| SCHEMBL28773717 | 0.90 | GRM2 (0.50) | GRM2CYP1A2ALDH1A1KDM4ETSHR | |
| SCHEMBL17054196 | 0.85 | CYP1A2 (0.37) | GRM2CYP1A2ALDH1A1KDM4ETSHR | |
| SCHEMBL29661864 | 0.85 | CYP1A2 (0.37) | GRM2CYP1A2ALDH1A1KDM4ETSHR | |
| SCHEMBL17054100 | 0.82 | KDM4E (0.50) | CYP1A2ALDH1A1KDM4ETSHRACHE | |
| SCHEMBL29661851 | 0.82 | KDM4E (0.50) | CYP1A2ALDH1A1KDM4ETSHRACHE | |
| SCHEMBL17054088 | 0.81 | CYP1A2 (0.60) | CYP1A2ALDH1A1KDM4ETSHRACHE | |
| SCHEMBL29661981 | 0.81 | CYP1A2 (0.60) | CYP1A2ALDH1A1KDM4ETSHRACHE | |
| SCHEMBL17054083 | 0.78 | KDM4E (0.44) | GRM2CYP1A2ALDH1A1KDM4ETSHR | |
| SCHEMBL17054193 | 0.77 | GRM2 (0.39) | GRM2CYP1A2ALDH1A1KDM4ETSHR |
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-110117246-B | Preparation method of 3-position indolylated cyclohexenone compound | 山西大学 | 2022-05-31 | — | — | CN | disclosed |