Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 3/20 | 0.52 |
| ▸ | ADH1A | P07327 | 3/20 | 0.52 |
| ▸ | ADH1C | P00326 | 2/20 | 0.52 |
| ▸ | ADH7 | P40394 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL514885 | 0.80 | — | — | |
| SCHEMBL309380 | 0.69 | — | — | |
| SCHEMBL26236 | 0.69 | — | — | |
| SCHEMBL13283251 | 0.69 | ADH1B (0.68) | ADH1BADH1AADH1CADH7 | |
| SCHEMBL19390046 | 0.67 | — | — | |
| SCHEMBL13066109 | 0.67 | — | — | |
| SCHEMBL22668472 | 0.67 | — | — | |
| SCHEMBL15172204 | 0.67 | ADH1B (0.64) | ADH1BADH1AADH1CADH7 | |
| SCHEMBL740044 | 0.67 | — | — | |
| SCHEMBL14069437 | 0.67 | ADH1B (0.56) | ADH1BADH1AADH1CADH7 |
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-2018102485-A1 | TETRACYCLIC HETEROCYCLE COMPOUNDS USEFUL AS HIV INTEGRASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-06-07 | — | — | WO | disclosed |