Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 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 | |
|---|---|---|---|---|
| SCHEMBL22848717 | 0.76 | ADH1B (0.31) | ADH1BADH1CADH1A | |
| SCHEMBL21737554 | 0.72 | — | — | |
| SCHEMBL22649447 | 0.69 | ADH1B (0.32) | ADH1BADH1CADH1A | |
| SCHEMBL3212369 | 0.67 | ADH1B (0.38) | ADH1BADH1CADH1A | |
| SCHEMBL3212377 | 0.67 | ADH1B (0.38) | ADH1BADH1CADH1A | |
| SCHEMBL23033236 | 0.63 | — | — | |
| SCHEMBL22649195 | 0.63 | ADH1B (0.33) | ADH1BADH1CADH1A | |
| SCHEMBL28944286 | 0.61 | ADH1B (0.32) | ADH1BADH1CADH1A | |
| SCHEMBL28768796 | 0.58 | TP53 (0.33) | — | |
| SCHEMBL19497436 | 0.58 | — | — |
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-2017215600-A1 | SUBSTITUTED TRICYCLIC HERTEOCYCLIC COMPOUNDS AND USE THEREOF | SUZHOU YABAO PHARMACEUTICAL R&D CO., LTD. (CN) | 2017-12-21 | — | — | WO | disclosed |