Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.46 |
| ▸ | FEN1 | P39748 | 3/20 | 0.44 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | FABP2 | P12104 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24026071 | 0.84 | PTPRC (0.50) | ALDH1A1FEN1ALOX5APBACE1MAPT | |
| SCHEMBL23989236 | 0.84 | ALDH1A1 (0.52) | ALDH1A1MAPK1FEN1ALOX5APESR1 | |
| SCHEMBL1536568 | 0.81 | ALDH1A1 (0.44) | ALDH1A1MAPK1RPS6KA3ESR1BACE1 | |
| SCHEMBL24723198 | 0.80 | RPS6KA3 (0.47) | ALDH1A1MAPK1RPS6KA3FEN1ALOX5AP | |
| SCHEMBL4354107 | 0.77 | ACMSD (0.47) | ALDH1A1KMT2AAKR1C3AKR1C2AKR1C1 | |
| SCHEMBL31232665 | 0.77 | MAPK1 (0.41) | ALDH1A1MAPK1RPS6KA3FEN1ALOX5AP | |
| SCHEMBL5717385 | 0.76 | ALDH1A1 (0.50) | ALDH1A1MAPK1BACE1MEN1KMT2A | |
| SCHEMBL19400433 | 0.75 | MEN1 (0.50) | FEN1ALOX5APESR1BACE1ALOX5 | |
| SCHEMBL30378050 | 0.75 | BACE1 (0.44) | ALDH1A1MAPK1RPS6KA3BACE1ALOX5 | |
| SCHEMBL26422275 | 0.75 | BACE1 (0.44) | ALDH1A1MAPK1RPS6KA3BACE1ALOX5 |
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-2022260119-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 |