Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 3/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.47 |
| ▸ | HSD17B1 | P14061 | 7/20 | 0.46 |
| ▸ | HSD17B2 | P37059 | 7/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27616562 | 0.85 | ESR2 (0.75) | ESR2HDAC4HDAC2HDAC8ALOX5 | |
| SCHEMBL297384 | 0.83 | ALOX5 (0.61) | ESR2HDAC4HDAC2HDAC8ALOX5 | |
| SCHEMBL19211556 | 0.81 | HDAC4 (0.66) | ESR2HDAC4HDAC2HDAC8ALOX5 | |
| SCHEMBL30335758 | 0.79 | HDAC4 (0.72) | ESR2HDAC4HDAC2HDAC8ALOX5 | |
| SCHEMBL30463004 | 0.79 | ESR2 (0.78) | ESR2HDAC4HDAC2HDAC8ALOX5 | |
| SCHEMBL598168 | 0.79 | HDAC4 (0.72) | ESR2HDAC4HDAC2HDAC8ALOX5 | |
| SCHEMBL217638 | 0.79 | ESR2 (0.78) | ESR2HDAC4HDAC2HDAC8ALOX5 | |
| SCHEMBL10934707 | 0.77 | HDAC4 (0.60) | ESR2HDAC4HDAC2HDAC8ALOX5 | |
| SCHEMBL29204860 | 0.76 | ESR2 (0.58) | ESR2HDAC4HDAC2HDAC8ALOX5 | |
| SCHEMBL29274331 | 0.76 | GSTP1 (0.64) | ESR2HDAC4HDAC2HDAC8ALOX5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113461504-B | Method for preparing macrocyclic ketone from epoxide | 中国天辰工程有限公司 | 2023-04-21 | — | — | CN | disclosed |