Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.41 |
| ▸ | KDM4A | O75164 | 1/20 | 0.39 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | 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 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL21279076 | 0.96 | ADORA2A (0.40) | ADORA2AADORA1KDM4AKDM5BALDH1A1 | |
| SCHEMBL21279068 | 0.91 | ALDH1A1 (0.39) | ADORA2AADORA1KDM4AKDM5BALDH1A1 | |
| SCHEMBL21279125 | 0.89 | KDM4E (0.33) | ADORA2AADORA1ALDH1A1HPGDMEN1 | |
| SCHEMBL19909437 | 0.88 | KDM5B (0.42) | ADORA2AADORA1KDM4AKDM5BALDH1A1 | |
| SCHEMBL21279095 | 0.87 | CHEK1 (0.38) | ALDH1A1MEN1KMT2A | |
| SCHEMBL21278728 | 0.86 | ALDH1A1 (0.37) | ADORA2AADORA1ALDH1A1HPGDMEN1 | |
| SCHEMBL21278729 | 0.86 | IRAK4 (0.33) | — | |
| SCHEMBL21279127 | 0.86 | KDM4E (0.35) | ADORA2AADORA1ALDH1A1HPGDKDM4E | |
| SCHEMBL19942681 | 0.86 | KDM5B (0.41) | ADORA2AADORA1KDM4AKDM5BALDH1A1 | |
| SCHEMBL22563586 | 0.86 | KDM4A (0.41) | ADORA2AADORA1KDM4AKDM5BALDH1A1 |
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-3399004-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-08-21 | — | — | EP | disclosed |