Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 6/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 3/20 | 0.34 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | GBA1 | P04062 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TSPO | P30536 | 2/20 | 0.32 |
| ▸ | WHR1 | P49842 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24028931 | 0.94 | ABCG2 (0.37) | ABCG2L3MBTL1PDE5AABCC1TSHR | |
| SCHEMBL24788320 | 0.88 | MEN1 (0.40) | ABCG2TSHRADORA3ADORA2AADORA1 | |
| SCHEMBL24034565 | 0.87 | MAPT (0.32) | ABCG2TSHRMEN1KMT2AMAPT | |
| SCHEMBL23018888 | 0.87 | MEN1 (0.40) | ABCG2L3MBTL1PDE5AABCC1TSHR | |
| SCHEMBL19119685 | 0.86 | CYP2D6 (0.34) | — | |
| SCHEMBL24753872 | 0.86 | MEN1 (0.41) | ABCG2TSHRADORA2AADORA1MEN1 | |
| SCHEMBL24034599 | 0.85 | CYP2C9 (0.34) | ABCG2TSHRALOX15ADORA3ADORA2A | |
| SCHEMBL21563732 | 0.85 | TSHR (0.39) | ABCG2L3MBTL1TSHRALOX15ADORA3 | |
| SCHEMBL24753874 | 0.84 | MEN1 (0.34) | ABCG2PDE5AADORA1MEN1KMT2A | |
| SCHEMBL19007355 | 0.83 | ADORA1 (0.38) | ABCG2L3MBTL1TSHRALOX15ADORA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021230689-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2021-11-18 | — | — | WO | disclosed |
| WO-2021230654-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2021-11-18 | — | — | WO | disclosed |