Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.34 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | LTK | P29376 | 1/20 | 0.33 |
| ▸ | GRK5 | P34947 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.33 |
| ▸ | MST1R | Q04912 | 1/20 | 0.33 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22112809 | 0.67 | — | — | |
| SCHEMBL19441243 | 0.62 | — | — | |
| SCHEMBL21447 | 0.61 | ALDH1A1 (0.61) | ALDH1A1HSD17B10HPGDBCL2L1CYP2A6 | |
| SCHEMBL2361430 | 0.61 | ALDH1A1 (0.61) | ALDH1A1HSD17B10HPGDBCL2L1CYP2A6 | |
| Benzene SCHEMBL28035419 | 0.61 | ALDH1A1 (0.61) | ALDH1A1HSD17B10HPGDBCL2L1CYP2A6 | |
| SCHEMBL19787487 | 0.60 | TDO2 (0.44) | ALDH1A1HSD17B10HPGDBCL2L1CYP2A6 | |
| SCHEMBL1039296 | 0.60 | ALDH1A1 (0.50) | ALDH1A1HSD17B10HPGDBCL2L1CYP2A6 | |
| SCHEMBL24513383 | 0.60 | BRD4 (0.33) | ALDH1A1TDO2KDM4ESLC6A4BACE1 | |
| Methyl Alcohol SCHEMBL27490755 | 0.60 | ALDH1A1 (0.60) | ALDH1A1HSD17B10HPGDBCL2L1CYP2A6 | |
| Methylamine SCHEMBL27430084 | 0.60 | ALDH1A1 (0.60) | ALDH1A1HSD17B10HPGDBCL2L1CYP2A6 |
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-2020122614-A1 | ORGANIC COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 두산솔루스 주식회사 | 2020-06-18 | — | — | WO | disclosed |