Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.34 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.34 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.34 |
| ▸ | SQOR | Q9Y6N5 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL23912050 | 0.97 | ADORA2A (0.36) | ADORA2AADORA1KDM4AKDM5BHPGD | |
| SCHEMBL20619419 | 0.94 | ADORA1 (0.39) | ADORA2AADORA1KDM4AKDM5BHPGD | |
| SCHEMBL23912068 | 0.92 | ALDH1A1 (0.37) | ADORA2AADORA1KDM4AKDM5BHPGD | |
| SCHEMBL23912045 | 0.92 | ADORA2A (0.36) | ADORA2AADORA1KDM4AKDM5BHPGD | |
| SCHEMBL20619417 | 0.91 | ADORA1 (0.37) | ADORA2AADORA1KDM4AKDM5BHPGD | |
| SCHEMBL23912103 | 0.88 | PTGS1 (0.37) | ADORA2AADORA1KDM4AKDM5BHPGD | |
| SCHEMBL23912101 | 0.87 | ADORA1 (0.40) | ADORA2AADORA1HPGDKDM4EPPARG | |
| SCHEMBL23912019 | 0.86 | ALDH1A1 (0.33) | KDM5BHPGDKDM4ESQORALDH1A1 | |
| SCHEMBL20619696 | 0.86 | ADORA1 (0.38) | ADORA2AADORA1HPGDKDM4EPPARG | |
| SCHEMBL20619413 | 0.86 | ADORA1 (0.37) | ADORA2AADORA1KDM4AKDM5BHPGD |
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-3645522-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2021-10-13 | — | — | EP | disclosed |