Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.32 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.32 |
| ▸ | UTRN | P46939 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23030691 | 0.92 | PDE10A (0.33) | PDE10AL3MBTL1HSD17B10CASP1SRC | |
| SCHEMBL22989112 | 0.89 | CASP1 (0.38) | PDE10AL3MBTL1HSD17B10CASP1ALDH1A1 | |
| SCHEMBL22989108 | 0.89 | CASP1 (0.42) | PDE10AL3MBTL1HSD17B10CASP1DHODH | |
| SCHEMBL22989116 | 0.89 | CASP1 (0.44) | PDE10AL3MBTL1HSD17B10CASP1ALDH1A1 | |
| SCHEMBL22989115 | 0.89 | AHR (0.33) | PDE10AL3MBTL1HSD17B10CASP1ALDH1A1 | |
| SCHEMBL22989218 | 0.87 | L3MBTL1 (0.36) | PDE10AL3MBTL1DHODHALDH1A1HPGD | |
| SCHEMBL23030487 | 0.84 | ALDH1A1 (0.37) | PDE10AL3MBTL1HSD17B10CASP1ALDH1A1 | |
| SCHEMBL21423222 | 0.84 | PDE10A (0.35) | PDE10AL3MBTL1HSD17B10CASP1NQO2 | |
| SCHEMBL22989263 | 0.84 | PDE10A (0.35) | PDE10AL3MBTL1NQO2DHODHSRC | |
| SCHEMBL22989118 | 0.84 | — | — |
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-2021029757-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2021-02-18 | — | — | WO | disclosed |