Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 6/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SQOR | Q9Y6N5 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | PDE9A | O76083 | 1/20 | 0.34 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL22562550 | 0.97 | ADORA1 (0.43) | ADORA1ADORA2AKDM4EHPGDNPSR1 | |
| SCHEMBL22562545 | 0.94 | ADORA1 (0.41) | ADORA1ADORA2AKDM4EHPGDNPSR1 | |
| SCHEMBL22562538 | 0.91 | ADORA2A (0.39) | ADORA1ADORA2AKDM4EHPGDNPSR1 | |
| SCHEMBL22562203 | 0.90 | ADORA1 (0.42) | ADORA1ADORA2AKDM4EHPGDNPSR1 | |
| SCHEMBL22562537 | 0.89 | ADORA1 (0.45) | ADORA1ADORA2AKDM4EHPGDNPSR1 | |
| SCHEMBL22562324 | 0.89 | ALDH1A1 (0.38) | ADORA1ADORA2AKDM4EHPGDNPSR1 | |
| SCHEMBL22562541 | 0.88 | ADORA2A (0.41) | ADORA1ADORA2AKDM4EHPGDNPSR1 | |
| SCHEMBL19909219 | 0.88 | ADORA2A (0.43) | ADORA1ADORA2AKDM4EHPGDNPSR1 | |
| SCHEMBL22562206 | 0.87 | ADORA1 (0.44) | ADORA1ADORA2AKDM4EHPGDNPSR1 | |
| SCHEMBL19909221 | 0.86 | PDE9A (0.34) | ADORA1ADORA2AKDM4EHPGDNPSR1 |
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-3418278-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-10-21 | — | — | EP | disclosed |