Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | HTR7 | P34969 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11181553 | 0.77 | TRPA1 (0.41) | CD44SIGMAR1CYP1A2CYP2A6KDM4E | |
| SCHEMBL3520282 | 0.77 | SIGMAR1 (0.46) | CD44SIGMAR1CA1CA2CA7 | |
| SCHEMBL22564432 | 0.76 | MYC (0.34) | SIGMAR1KDM4EGAAMAPTALDH1A1 | |
| SCHEMBL658146 | 0.76 | CD44 (0.50) | CD44SIGMAR1CYP1A2CYP2A6KDM4E | |
| Hydrochloric Acid SCHEMBL11560306 | 0.75 | SIGMAR1 (0.44) | SIGMAR1CA1CA2CA7CA9 | |
| SCHEMBL22564442 | 0.74 | GABRA1 (0.39) | SIGMAR1CYP1A2CA1CA2TSHR | |
| SCHEMBL22564255 | 0.74 | NPSR1 (0.36) | — | |
| SCHEMBL22563913 | 0.74 | GABRA1 (0.39) | KDM4EMAPTALDH1A1AOC3 | |
| SCHEMBL169686 | 0.72 | — | — | |
| SCHEMBL22563911 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2841429-B1 | TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES | SUMITOMO CHEMICAL CO (JP) | 2020-10-21 | — | — | EP | disclosed |