Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL8587808 | 0.87 | GAA (0.37) | ALDH1A1KDM4ENPC1GAACDK1 | |
| SCHEMBL119097 | 0.80 | GAA (0.52) | ALDH1A1KDM4ENPC1GAACDK1 | |
| SCHEMBL29371340 | 0.80 | GAA (0.52) | ALDH1A1KDM4ENPC1GAACDK1 | |
| SCHEMBL8936702 | 0.78 | GAA (0.42) | ALDH1A1KDM4ENPC1GAACDK1 | |
| Chlorimuron Ethyl SCHEMBL9422513 | 0.76 | ALDH1A1 (0.45) | ALDH1A1KDM4ENPC1GAACDK1 | |
| SCHEMBL6642783 | 0.75 | GAA (0.39) | ALDH1A1GAACDK1MAPTSMN1; SMN2 | |
| SCHEMBL10469643 | 0.75 | GAA (0.59) | GAACDK1MAPTTP53GLA | |
| SCHEMBL9534581 | 0.73 | ALDH1A1 (0.42) | ALDH1A1KDM4ENPC1GAACDK1 | |
| SCHEMBL10506007 | 0.73 | TSHR (0.53) | GAACDK1MAPTSMN1; SMN2TP53 | |
| SCHEMBL10341393 | 0.73 | GAA (0.52) | ALDH1A1KDM4ENPC1GAACDK1 |
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-5563112-A | Herbicidal diphenyl ether and nitrogen solution compositions and method | ZENECA LIMITED (GB) | 1996-10-08 | — | — | US | disclosed |
| US-5173105-A | Herbicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-12-22 | — | — | US | disclosed |
| US-5152826-A | Herbicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-10-06 | — | — | US | disclosed |
| US-5076832-A | Certain 3-(substituted phenyl)-5-(substituted phenyl)-1-ethylimidazolidine-4-ones as herbicides | ICI AMERICAS INC. (US) | 1991-12-31 | — | — | US | disclosed |