Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.32 |
| ▸ | CHRNG | P07510 | 1/20 | 0.32 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | CHRND | Q07001 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24747816 | 0.99 | HDAC4 (0.33) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL26001667 | 0.95 | HSD17B1 (0.35) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL26001675 | 0.94 | ESR1 (0.34) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL24749246 | 0.94 | CHRNA1 (0.32) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL26001662 | 0.93 | HSD17B1 (0.33) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL26001673 | 0.93 | HSD17B1 (0.33) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL24749840 | 0.93 | HSD17B1 (0.32) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL24751026 | 0.93 | HSD17B1 (0.32) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL24748326 | 0.93 | HSD17B1 (0.32) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL24749205 | 0.92 | HSD17B1 (0.31) | HSD17B1HSD17B2CHRNA1CHRNGCHRNB1 |
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-2022259886-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE | 出光興産株式会社 | 2022-12-15 | — | — | WO | disclosed |