Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 5/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20267210 | 0.86 | ALDH1A1 (0.64) | ALDH1A1TDP1TSHRL3MBTL1LMNA | |
| SCHEMBL31490936 | 0.85 | ALDH1A1 (0.79) | ALDH1A1TDP1TSHRL3MBTL1LMNA | |
| SCHEMBL39575 | 0.85 | ALDH1A1 (0.79) | ALDH1A1TDP1TSHRL3MBTL1LMNA | |
| Ethyl Salicylate SCHEMBL27816869 | 0.84 | ALDH1A1 (0.71) | ALDH1A1TDP1TSHRL3MBTL1LMNA | |
| SCHEMBL28250478 | 0.84 | ALDH1A1 (0.66) | ALDH1A1TDP1TSHRL3MBTL1LMNA | |
| SCHEMBL27856813 | 0.84 | ALDH1A1 (0.76) | ALDH1A1TDP1TSHRL3MBTL1LMNA | |
| SCHEMBL416812 | 0.84 | ALDH1A1 (0.76) | ALDH1A1TDP1TSHRL3MBTL1LMNA | |
| Propylparaben SCHEMBL5473575 | 0.83 | ESR1 (0.66) | ALDH1A1TDP1TSHRLMNAKDM4E | |
| Bicarbonate SCHEMBL30206837 | 0.82 | ALDH1A1 (0.73) | ALDH1A1TDP1TSHRL3MBTL1LMNA | |
| Bicarbonate SCHEMBL21753664 | 0.82 | ALDH1A1 (0.73) | ALDH1A1TDP1TSHRL3MBTL1LMNA |
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-0001864-A1 | Novel 6-oxygenated-3,20-dioxo-pregnane derivatives, process for the preparation thereof, and pharmaceutical compositions containing them | Technobiotic Ltd. (CH) | 1979-05-16 | — | — | EP | disclosed |