Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 1/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.31 |
| ▸ | LPL | P06858 | 1/20 | 0.30 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.30 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22425441 | 0.99 | HSD17B1 (0.34) | HSD17B1HSD17B2ESR1ESR2HDAC4 | |
| SCHEMBL22425563 | 0.99 | HSD17B1 (0.34) | HSD17B1HSD17B2ESR1ESR2HDAC4 | |
| SCHEMBL19001948 | 0.96 | PDK2 (0.35) | HSD17B1HSD17B2ESR1ESR2PDK2 | |
| SCHEMBL24817269 | 0.95 | HSD17B1 (0.33) | HSD17B1HSD17B2HDAC4HDAC2HDAC8 | |
| SCHEMBL22425425 | 0.95 | ESR1 (0.35) | HSD17B1HSD17B2ESR1ESR2HDAC4 | |
| SCHEMBL24646423 | 0.95 | ESR1 (0.35) | HSD17B1HSD17B2ESR1ESR2HDAC4 | |
| SCHEMBL22425639 | 0.95 | HSD17B1 (0.36) | HSD17B1HSD17B2ESR1ESR2HDAC4 | |
| SCHEMBL19011240 | 0.95 | HSD17B1 (0.36) | HSD17B1HSD17B2ESR1ESR2HDAC4 | |
| SCHEMBL18371337 | 0.95 | HSD17B1 (0.36) | HSD17B1HSD17B2ESR1ESR2HDAC4 | |
| SCHEMBL23179644 | 0.94 | HSD17B1 (0.35) | HSD17B1HSD17B2ESR1ESR2HDAC4 |
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-2022270296-A1 | COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2022-12-29 | — | — | WO | disclosed |