Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 6/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| 1-Hexanol SCHEMBL537293 | 0.94 | LMNA (0.61) | LMNAALDH1A1HSD17B10TSHRMEN1 | |
| Cetyl Alcohol SCHEMBL7713541 | 0.94 | LMNA (0.61) | LMNAALDH1A1HSD17B10TSHRMEN1 | |
| Nonanol SCHEMBL10363769 | 0.94 | LMNA (0.61) | LMNAALDH1A1HSD17B10TSHRMEN1 | |
| Octanol SCHEMBL492895 | 0.94 | LMNA (0.61) | LMNAALDH1A1HSD17B10TSHRMEN1 | |
| 1-Heptanol SCHEMBL2461694 | 0.94 | LMNA (0.61) | LMNAALDH1A1HSD17B10TSHRMEN1 | |
| 1-Hexanol SCHEMBL20395883 | 0.92 | ALDH1A1 (0.58) | LMNAALDH1A1HSD17B10TSHRMEN1 | |
| Heptane SCHEMBL1591796 | 0.92 | ALDH1A1 (0.64) | LMNAALDH1A1HSD17B10TSHRMEN1 | |
| 1-Pentanol SCHEMBL3390919 | 0.92 | ALDH1A1 (0.64) | LMNAALDH1A1HSD17B10TSHRMEN1 | |
| Hexane SCHEMBL5317425 | 0.91 | ALDH1A1 (0.52) | LMNAALDH1A1HSD17B10TSHRMEN1 | |
| Ethyl Acetate SCHEMBL28275742 | 0.90 | ALDH1A1 (0.56) | LMNAALDH1A1HSD17B10TSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0836599-A1 | 1,6-DISUBSTITUTED ISOCHROMANS FOR TREATMENT OF MIGRAINE HEADACHES | PHARMACIA & UPJOHN COMPANY (US) | 1998-04-22 | — | — | EP | disclosed |