Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.44 |
| ▸ | OGG1 | O15527 | 1/20 | 0.37 |
| ▸ | F9 | P00740 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | PLK4 | O00444 | 1/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25567689 | 0.82 | CYP2A6 (0.42) | CYP2A6MCL1MAPK1LIMK1OGG1 | |
| SCHEMBL25569776 | 0.82 | LIMK1 (0.46) | CYP2A6MCL1MAPK1LIMK1F9 | |
| SCHEMBL31568860 | 0.82 | MAPK1 (0.53) | CYP2A6MCL1MAPK1OGG1MEN1 | |
| SCHEMBL24627946 | 0.82 | APP (0.44) | MCL1MAPK1MEN1ALDH1A1KMT2A | |
| SCHEMBL25567635 | 0.82 | ALOX5 (0.46) | CYP2A6MCL1MAPK1LIMK1OGG1 | |
| SCHEMBL23765004 | 0.81 | MAPK1 (0.41) | CYP2A6MCL1MAPK1LIMK1OGG1 | |
| SCHEMBL24969647 | 0.81 | LIMK1 (0.48) | CYP2A6MCL1MAPK1LIMK1F9 | |
| SCHEMBL22019102 | 0.81 | CYP2A6 (0.47) | CYP2A6MCL1MAPK1LIMK1OGG1 | |
| SCHEMBL24627986 | 0.80 | ABL1 (0.43) | CYP2A6MAPK1LIMK1MEN1ALDH1A1 | |
| SCHEMBL24627987 | 0.79 | ABL1 (0.39) | CYP2A6MCL1MAPK1LIMK1MEN1 |
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-2023003234-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2023-01-26 | — | — | WO | disclosed |