Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16637718 | 0.86 | ALDH1A1 (0.34) | TDP1ALDH1A1KDM4EHSD17B10POLB | |
| SCHEMBL17307605 | 0.84 | TSHR (0.31) | ALDH1A1KDM4E | |
| SCHEMBL25394391 | 0.84 | TSHR (0.33) | ALDH1A1KDM4EHSD17B10MEN1KMT2A | |
| SCHEMBL1469446 | 0.84 | TSHR (0.33) | ALDH1A1KDM4EHSD17B10MEN1KMT2A | |
| SCHEMBL22442289 | 0.81 | TDP1 (0.53) | TDP1HSD17B10 | |
| SCHEMBL12358336 | 0.80 | TSHR (0.43) | TDP1ALDH1A1HSD17B10 | |
| Ether SCHEMBL15332713 | 0.80 | TSHR (0.41) | TDP1ALDH1A1KDM4EHSD17B10MEN1 | |
| SCHEMBL16533116 | 0.78 | TSHR (0.39) | ALDH1A1KDM4E | |
| SCHEMBL15333361 | 0.78 | TDP1 (0.43) | TDP1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL1471540 | 0.78 | HPGD (0.33) | ALDH1A1KDM4E |
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-2015051402-A1 | ALKYLATION OF PHENOLIC COMPOUNDS | THE UNIVERSITY OF SYDNEY (AU) | 2015-04-16 | — | — | WO | disclosed |