Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.43 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 6/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.37 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5686699 | 0.71 | SLC6A3 (0.45) | SLC6A3KCNN4CHRM2CHRM4CHRM1 | |
| SCHEMBL8762985 | 0.70 | KEAP1 (0.46) | SLC6A3ALDH1A1KEAP1NFE2L2CYP1A2 | |
| SCHEMBL4010466 | 0.68 | SLC6A3 (0.43) | SLC6A3KCNN4CHRM2CHRM4CHRM1 | |
| SCHEMBL38654851 | 0.68 | SLC6A3 (0.36) | SLC6A3ALDH1A1 | |
| SCHEMBL15106304 | 0.68 | CYP1A2 (0.43) | SLC6A3ALDH1A1CYP1A2SIGMAR1 | |
| SCHEMBL14300775 | 0.67 | KEAP1 (0.37) | SLC6A3ALDH1A1KEAP1NFE2L2CYP2C19 | |
| SCHEMBL28542144 | 0.67 | KCNN4 (0.60) | KCNN4CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL8028322 | 0.67 | MEN1 (0.41) | SLC6A3ALDH1A1CYP1A2 | |
| SCHEMBL7959301 | 0.66 | KCNN4 (0.58) | KCNN4CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL6902537 | 0.66 | KEAP1 (0.36) | SLC6A3ALDH1A1KEAP1NFE2L2CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6313150-B1 | FOR CONTROLLING PHYTOPATHOGENIC FUNGI | SHIONOGI & CO., LTD. (JP) | 2001-11-06 | — | — | US | disclosed |
| EP-0754672-B1 | GAMMA-SUBSTITUTED PHENYLACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND AGRICULTURAL BACTERICIDE CONTAINING THE SAME | SHIONOGI & CO (JP) | 2000-10-11 | — | — | EP | disclosed |
| US-5948819-A | α-substituted phenylacetic acid derivative, its production and agricultural fungicide containing it | SHIONOGI & CO., LTD (JP) | 1999-09-07 | — | — | US | disclosed |
| EP-0754672-A1 | GAMMA-SUBSTITUTED PHENYLACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND AGRICULTURAL BACTERICIDE CONTAINING THE SAME | SHIONOGI & CO., LTD. (JP) | 1997-01-22 | — | — | EP | disclosed |