Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.60 |
| ▸ | ABHD6 | Q9BV23 | 12/20 | 0.46 |
| ▸ | MGLL | Q99685 | 5/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25825941 | 0.85 | ESR1 (0.80) | ESR1ESR2ABHD6MGLL | |
| SCHEMBL31670368 | 0.78 | HDAC6 (0.55) | ESR1ESR2ABHD6HDAC8HDAC6 | |
| SCHEMBL7277197 | 0.76 | NOTUM (0.53) | ESR1ESR2ABHD6MGLL | |
| SCHEMBL4727849 | 0.76 | ABHD6 (0.58) | ESR1ESR2ABHD6MGLL | |
| SCHEMBL10214641 | 0.75 | HDAC6 (0.56) | ESR1ESR2ABHD6HDAC8HDAC6 | |
| SCHEMBL29100405 | 0.75 | NOTUM (0.58) | ESR1ESR2ABHD6 | |
| SCHEMBL25604135 | 0.75 | ESR2 (0.77) | ESR1ESR2ABHD6HDAC8HDAC6 | |
| SCHEMBL3895230 | 0.75 | ESR1 (1.00) | ESR1ESR2ABHD6HDAC8HDAC6 | |
| SCHEMBL31164691 | 0.75 | ESR1 (0.90) | ESR1ESR2ABHD6PKM | |
| SCHEMBL25604095 | 0.75 | ABHD6 (0.54) | ESR1ESR2ABHD6ACHE |
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-2023088406-A1 | FUSED IMIDE DERIVATIVE | 正大天晴药业集团股份有限公司 | 2023-05-25 | — | — | WO | disclosed |