Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4316553 | 1.00 | ALDH1A1 (0.52) | ALDH1A1NFE2L2RAB9AKDM4EHPGD | |
| SCHEMBL14584900 | 1.00 | ALDH1A1 (0.52) | ALDH1A1NFE2L2RAB9AKDM4EHPGD | |
| SCHEMBL4268024 | 0.89 | ALDH1A1 (0.48) | ALDH1A1RAB9AKDM4EHPGDCYP2C19 | |
| SCHEMBL10015739 | 0.89 | NFE2L2 (0.56) | ALDH1A1NFE2L2RAB9ARELAMEN1 | |
| SCHEMBL5953353 | 0.89 | NFE2L2 (0.56) | ALDH1A1NFE2L2RAB9ARELAMEN1 | |
| SCHEMBL5492449 | 0.89 | NFE2L2 (0.56) | ALDH1A1NFE2L2RAB9ARELAMEN1 | |
| SCHEMBL4585021 | 0.89 | ALDH1A1 (0.48) | ALDH1A1RAB9AKDM4EHPGDCYP2C19 | |
| SCHEMBL3629423 | 0.89 | NFE2L2 (0.56) | ALDH1A1NFE2L2RAB9ARELAMEN1 | |
| SCHEMBL20663990 | 0.89 | NFE2L2 (0.56) | ALDH1A1NFE2L2RAB9ARELAMEN1 | |
| SCHEMBL16489726 | 0.89 | NFE2L2 (0.56) | ALDH1A1NFE2L2RAB9ARELAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1888706-B1 | ORGANIC ELECTROLUMINESCENT DEVICE AND BORIC ACID AND BORINIC ACID DERIVATIVES USED THEREIN | MERCK PATENT GMBH (DE) | 2017-03-01 | — | — | EP | disclosed |