Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| Tetrahydrofuran SCHEMBL5050358 | 0.83 | ALDH1A1 (0.44) | ALDH1A1TSHRMAPT | |
| Tetrahydrofuran SCHEMBL8503112 | 0.83 | ALDH1A1 (0.44) | ALDH1A1TSHRMAPT | |
| Acetone SCHEMBL4379179 | 0.82 | LMNA (0.43) | TSHR | |
| SCHEMBL1346214 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TSHRMAPT | |
| Acetic Acid SCHEMBL15439482 | 0.79 | FFAR3 (0.47) | — | |
| Fluoride SCHEMBL28865812 | 0.78 | — | — | |
| Dioxane SCHEMBL1346219 | 0.77 | SMN1; SMN2 (0.46) | ALDH1A1TSHRMAPT | |
| Acetic Acid SCHEMBL6125476 | 0.77 | FFAR3 (0.44) | — | |
| SCHEMBL718701 | 0.77 | — | — | |
| Acetic Acid SCHEMBL4544141 | 0.77 | FFAR3 (0.44) | — |
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-8193379-B2 | Method for preparing 4B-amino-4′-demethyl-4-desoxypodophyllotoxin | Medicament, Pierre Fabre (FR) | 2012-06-05 | — | — | US | claimed |