Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 6/20 | 0.54 |
| ▸ | FAAH | O00519 | 6/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | DGKA | P23743 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 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 | |
|---|---|---|---|---|
| Ethyl Acetate SCHEMBL10707135 | 1.00 | ALDH1A1 (0.58) | ALDH1A1LMNAHSD17B10TSHRFAAH | |
| Ethyl Acetate SCHEMBL27912255 | 0.98 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10TSHRFAAH | |
| Hexane SCHEMBL6272474 | 0.94 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10TSHRFAAH | |
| Ethyl Acetate SCHEMBL28478462 | 0.94 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TSHRFAAH | |
| Heptane SCHEMBL1591796 | 0.91 | ALDH1A1 (0.64) | ALDH1A1LMNAHSD17B10TSHRFAAH | |
| Ethyl Acetate SCHEMBL4582917 | 0.91 | ALDH1A1 (0.64) | ALDH1A1LMNAHSD17B10TSHRFAAH | |
| Hexane SCHEMBL6948245 | 0.89 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TSHRFAAH | |
| Hexane SCHEMBL6948482 | 0.89 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TSHRFAAH | |
| Hexadecane SCHEMBL3291441 | 0.89 | ALDH1A1 (0.74) | ALDH1A1LMNAHSD17B10TSHRFAAH | |
| Heptane SCHEMBL1190938 | 0.89 | ALDH1A1 (0.74) | ALDH1A1LMNAHSD17B10TSHRFAAH |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005070889-A1 | HERBICIDAL AMIDES | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2005-08-04 | — | — | WO | disclosed |