Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC8A1 | P32418 | 16/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11050225 | 0.79 | MAOB (0.58) | SLC8A1ESR1ESR2 | |
| SCHEMBL29974186 | 0.79 | MAOB (0.58) | SLC8A1ESR1ESR2 | |
| SCHEMBL10071651 | 0.79 | SLC8A1 (0.43) | SLC8A1 | |
| SCHEMBL28917604 | 0.78 | ESR1 (0.47) | SLC8A1ESR1ESR2 | |
| Flavane SCHEMBL26661841 | 0.78 | ESR1 (0.54) | SLC8A1ESR1ESR2 | |
| SCHEMBL1687992 | 0.78 | SLC8A1 (0.43) | SLC8A1 | |
| Flavane SCHEMBL28117046 | 0.77 | ESR1 (0.48) | SLC8A1ESR1ESR2 | |
| SCHEMBL29974353 | 0.77 | ESR2 (0.71) | ESR1ESR2 | |
| SCHEMBL6261080 | 0.77 | ESR2 (0.71) | ESR1ESR2 | |
| Flavane SCHEMBL123287 | 0.76 | ESR1 (0.51) | SLC8A1ESR1ESR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4461907-A | Amino-substituted flavans useful as anti-viral agents | BURROUGHS WELLCOME CO. | 1984-07-24 | — | — | US | disclosed |
| EP-0051061-A2 | Novel intermediates and process for their preparation | THE WELLCOME FOUNDATION LIMITED (GB) | 1982-05-05 | — | — | EP | disclosed |
| EP-0004579-A1 | Flavans, process for their preparation and pharmaceutical compositions containing them | THE WELLCOME FOUNDATION LIMITED (GB) | 1979-10-17 | — | — | EP | disclosed |