Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 6/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.38 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20619477 | 0.95 | PTGS1 (0.38) | ADORA1ADORA2AKDM4EPTGS1PTGS2 | |
| SCHEMBL23912103 | 0.93 | PTGS1 (0.37) | ADORA1ADORA2AADORA2BKDM4EHPGD | |
| SCHEMBL20619419 | 0.93 | ADORA1 (0.39) | ADORA1ADORA2AADORA2BKDM4EHPGD | |
| SCHEMBL20619696 | 0.93 | ADORA1 (0.38) | ADORA1ADORA2AADORA2BKDM4EHPGD | |
| SCHEMBL23912104 | 0.92 | ADORA1 (0.40) | ADORA1ADORA2AADORA2BKDM4EHPGD | |
| SCHEMBL20619453 | 0.91 | TDO2 (0.38) | ADORA1ADORA2APTGS1PTGS2ALDH1A1 | |
| SCHEMBL20619417 | 0.90 | ADORA1 (0.37) | ADORA1ADORA2AADORA2BKDM4EHPGD | |
| SCHEMBL20619412 | 0.90 | PTGS1 (0.37) | ADORA1ADORA2AKDM4EPTGS1PTGS2 | |
| SCHEMBL20619690 | 0.90 | ADORA1 (0.36) | ADORA1ADORA2AADORA2BKDM4EHPGD | |
| SCHEMBL23912068 | 0.89 | ALDH1A1 (0.37) | ADORA1ADORA2AKDM4EHPGDPTGS1 |
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 |