Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20754057 | 0.95 | AHR (0.44) | ALDH1A1KDM4EMAPTHPGDMAPK1 | |
| SCHEMBL22061689 | 0.93 | ALOX5 (0.44) | ALDH1A1KDM4EMAPTHPGDMAPK1 | |
| SCHEMBL22061615 | 0.93 | KMT2A (0.43) | ALDH1A1KDM4EMAPTHPGDMAPK1 | |
| SCHEMBL22061220 | 0.88 | KMT2A (0.41) | ALDH1A1KDM4EMAPTHPGDMAPK1 | |
| SCHEMBL22851286 | 0.87 | ALOX5 (0.41) | ALDH1A1KDM4EMAPTHPGDHSD17B10 | |
| SCHEMBL21926816 | 0.87 | AHR (0.48) | ALDH1A1KDM4EMAPTHPGDMAPK1 | |
| SCHEMBL21926211 | 0.87 | AHR (0.48) | ALDH1A1KDM4EMAPTHPGDMAPK1 | |
| SCHEMBL22767262 | 0.87 | KMT2A (0.41) | ALDH1A1KDM4EMAPTHPGDHSD17B10 | |
| SCHEMBL24215861 | 0.86 | ALOX5 (0.45) | ALDH1A1KDM4EMAPTHPGDHSD17B10 | |
| SCHEMBL22061622 | 0.86 | MAPK1 (0.47) | ALDH1A1KDM4EHPGDMAPK1SMN1; SMN2 |
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-2020111663-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME | 두산솔루스 주식회사 | 2020-06-04 | — | — | WO | disclosed |