Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B2 | P37059 | 10/20 | 0.53 |
| ▸ | HSD17B1 | P14061 | 9/20 | 0.53 |
| ▸ | ESR1 | P03372 | 5/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.53 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.53 |
| ▸ | SRC | P12931 | 1/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30530215 | 1.00 | HSD17B2 (0.53) | HSD17B2HSD17B1ESR1ESR2CYP3A4 | |
| SCHEMBL29793267 | 0.82 | ESR2 (0.50) | ESR1ESR2CYP3A4CYP1A2 | |
| SCHEMBL7836070 | 0.82 | ESR2 (0.50) | ESR1ESR2CYP3A4CYP1A2 | |
| SCHEMBL11375661 | 0.77 | HSD17B1 (0.52) | HSD17B2HSD17B1ESR1ESR2CYP3A4 | |
| SCHEMBL31316500 | 0.76 | HSD17B2 (0.60) | HSD17B2HSD17B1ESR1ESR2CYP3A4 | |
| SCHEMBL14329494 | 0.74 | KIF11 (0.41) | — | |
| SCHEMBL29970876 | 0.73 | MEN1 (0.46) | ESR1ESR2CYP1A2 | |
| SCHEMBL21769097 | 0.73 | HSD17B2 (0.53) | HSD17B2HSD17B1ESR1ESR2CYP3A4 | |
| SCHEMBL21751200 | 0.73 | HSD17B2 (0.53) | HSD17B2HSD17B1ESR1ESR2CYP3A4 | |
| Propane SCHEMBL5843489 | 0.72 | HSD17B1 (0.71) | HSD17B2HSD17B1ESR1ESR2CYP3A4 |
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-110845649-A | Polymer, organic layer composition and method of forming pattern | 三星SDI株式会社 | 2020-02-28 | — | — | CN | disclosed |