Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 10/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.35 |
| ▸ | PPARA | Q07869 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ADH1B | P00325 | 1/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
| ▸ | ADH4 | P08319 | 1/20 | 0.32 |
| ▸ | ADH7 | P40394 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL24319672 | 0.75 | ALDH1A1 (0.47) | ALDH1A1KDM4EEPHX1TSHRADH1B | |
| SCHEMBL7158082 | 0.74 | EPHX1 (0.42) | ALDH1A1KDM4EEPHX1DNM1PPARA | |
| SCHEMBL11509395 | 0.73 | KDM4E (0.39) | ALDH1A1KDM4EEPHX1TSHRADH1B | |
| SCHEMBL11511106 | 0.72 | CYP2D6 (0.40) | ALDH1A1KDM4EEPHX1OPRM1 | |
| Bromide SCHEMBL7948654 | 0.70 | DNM1 (0.39) | ALDH1A1KDM4EEPHX1DNM1TSHR | |
| SCHEMBL17254503 | 0.70 | ALDH1A1 (0.40) | ALDH1A1KDM4EEPHX1TSHRADH1B | |
| Bromide SCHEMBL10942615 | 0.69 | DNM1 (0.37) | ALDH1A1KDM4EEPHX1DNM1TSHR | |
| SCHEMBL28850818 | 0.69 | RRM1 (0.42) | ALDH1A1EPHX1DNM1TSHR | |
| SCHEMBL11260951 | 0.69 | EPHX1 (0.46) | ALDH1A1KDM4EEPHX1DNM1PPARA | |
| SCHEMBL918437 | 0.68 | RRM1 (0.49) | ALDH1A1KDM4EEPHX1DNM1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4397677-A | HERBICIDES | VELSICOL CHEMICAL CORPORATION (US) | 1983-08-09 | — | — | US | disclosed |