Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.56 |
| ▸ | NQO2 | P16083 | 1/20 | 0.56 |
| ▸ | APP | P05067 | 2/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13978933 | 0.88 | NQO1 (0.57) | NQO1NQO2APPHSD17B1HSD17B2 | |
| SCHEMBL13979021 | 0.86 | NQO1 (0.55) | NQO1NQO2APPHSD17B1HSD17B2 | |
| SCHEMBL13979064 | 0.86 | NQO1 (0.55) | NQO1NQO2APPHSD17B1HSD17B2 | |
| SCHEMBL28113158 | 0.86 | NQO1 (0.54) | NQO1NQO2APPHSD17B1HSD17B2 | |
| SCHEMBL12115251 | 0.82 | NQO1 (0.58) | NQO1NQO2APPHSD17B1HSD17B2 | |
| SCHEMBL18858091 | 0.82 | NQO1 (0.63) | NQO1NQO2APPHSD17B1HSD17B2 | |
| SCHEMBL2966644 | 0.80 | ALDH1A1 (0.52) | NQO1ALDH1A1HIF1AHSD17B10HPGD | |
| SCHEMBL19678607 | 0.79 | NQO1 (0.55) | NQO1NQO2APPHSD17B1HSD17B2 | |
| SCHEMBL19497669 | 0.77 | NQO1 (0.51) | NQO1NQO2APPHSD17B1HSD17B2 | |
| SCHEMBL18858104 | 0.77 | NQO1 (0.49) | NQO1NQO2APPHSD17B1HSD17B2 |
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-2023132488-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2023-07-13 | — | — | WO | disclosed |