Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | ANPEP | P15144 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | LIPE | Q05469 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11767314 | 0.81 | HPGD (0.41) | ALDH1A1 | |
| Fluoride SCHEMBL11728897 | 0.79 | HPGD (0.39) | ALDH1A1 | |
| SCHEMBL31319062 | 0.78 | ALDH1A1 (0.46) | EPHX1ACHEANPEPALDH1A1KDM4E | |
| SCHEMBL11766752 | 0.75 | SCN2A (0.56) | ACHEALDH1A1 | |
| SCHEMBL11770964 | 0.73 | ALDH1A1 (0.41) | ALDH1A1CES2CES1 | |
| SCHEMBL11332669 | 0.73 | ALDH1A1 (0.50) | EPHX1ACHEANPEPALDH1A1KDM4E | |
| SCHEMBL11769694 | 0.73 | CA1 (0.47) | ACHEALDH1A1CES2CES1 | |
| SCHEMBL11768056 | 0.72 | CYP2C19 (0.46) | ALDH1A1CES2CES1 | |
| SCHEMBL11773358 | 0.72 | SMN1; SMN2 (0.40) | ALDH1A1KDM4ECES2CES1 | |
| SCHEMBL1479596 | 0.71 | ANPEP (0.49) | EPHX1ANPEPALDH1A1KDM4ECES2 |
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-3997549-A | INSECTICIDE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1976-12-14 | — | — | US | disclosed |