Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18469028 | 1.00 | ADORA3 (0.45) | ADORA3ADORA2AADORA2BADORA1TSHR | |
| SCHEMBL18468605 | 0.96 | ADORA3 (0.47) | ADORA3ADORA2AADORA2BADORA1TSHR | |
| SCHEMBL29750333 | 0.96 | ADORA3 (0.47) | ADORA3ADORA2AADORA2BADORA1TSHR | |
| SCHEMBL24353277 | 0.94 | ADORA3 (0.46) | ADORA3ADORA2AADORA2BADORA1TSHR | |
| SCHEMBL32682800 | 0.94 | ADORA3 (0.46) | ADORA3ADORA2AADORA2BADORA1TSHR | |
| SCHEMBL24657066 | 0.94 | GPR55 (0.48) | ADORA3ADORA2AADORA2BADORA1TSHR | |
| SCHEMBL17141996 | 0.92 | ALDH1A1 (0.48) | ADORA3ADORA2AADORA2BADORA1TSHR | |
| SCHEMBL25875264 | 0.91 | MEN1 (0.54) | ADORA3ADORA2AADORA2BADORA1TSHR | |
| SCHEMBL17720965 | 0.90 | L3MBTL1 (0.52) | ADORA3ADORA2AADORA2BADORA1TSHR | |
| SCHEMBL27455503 | 0.90 | L3MBTL1 (0.52) | ADORA3ADORA2AADORA2BADORA1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112888693-B | Polycyclic compound and organic electroluminescent device including the same | 出光兴产株式会社 | 2024-09-24 | — | — | CN | disclosed |
| CN-116348454-A | Triazine compound, material for organic electroluminescent element, electron-transporting material for organic electroluminescent element, and organic electroluminescent element | 东曹株式会社 | 2023-06-27 | — | — | CN | disclosed |
| WO-2022075219-A1 | TRIAZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT | 東ソー株式会社 | 2022-04-14 | — | — | WO | disclosed |