Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22562586 | 0.92 | ADORA2A (0.38) | ADORA2AADORA1KDM4ENPSR1HPGD | |
| SCHEMBL22562579 | 0.89 | ALDH1A3 (0.36) | ADORA2AADORA1KDM4ENPSR1HPGD | |
| SCHEMBL19913284 | 0.89 | KDM4E (0.39) | ADORA2AADORA1KDM4ENPSR1HPGD | |
| SCHEMBL22562278 | 0.87 | ALDH1A3 (0.41) | ADORA2AADORA1KDM4ENPSR1HPGD | |
| SCHEMBL23487584 | 0.87 | ADORA2A (0.37) | ADORA2AADORA1KDM4ENPSR1HPGD | |
| SCHEMBL22562584 | 0.86 | ALDH1A3 (0.35) | ADORA2AADORA1KDM4ENPSR1HPGD | |
| SCHEMBL22562550 | 0.86 | ADORA1 (0.43) | ADORA2AADORA1KDM4ENPSR1HPGD | |
| SCHEMBL22562587 | 0.86 | ALDH1A3 (0.39) | ADORA2AADORA1KDM4ENPSR1HPGD | |
| SCHEMBL22562402 | 0.85 | MAPT (0.35) | KDM4ENPSR1MAPTMETAP2ALDH1A1 | |
| SCHEMBL22562272 | 0.84 | ALDH1A3 (0.36) | ALDH1A3METAP2MYCMEN1KMT2A |
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 |