Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | SQOR | Q9Y6N5 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | HPGD | P15428 | 5/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25037962 | 0.92 | HSD17B10 (0.36) | CYP11B1SQORHSD17B10ADORA2AADORA1 | |
| SCHEMBL25035999 | 0.90 | HSD17B10 (0.35) | CYP11B1SQORHSD17B10ADORA2AADORA1 | |
| SCHEMBL25036005 | 0.90 | PIM1 (0.43) | CYP11B1SQORHSD17B10ADORA2AADORA1 | |
| SCHEMBL25037965 | 0.89 | PIM1 (0.43) | CYP11B1SQORHSD17B10ADORA2AADORA1 | |
| SCHEMBL25038437 | 0.88 | HSD17B10 (0.41) | CYP11B1SQORHSD17B10ADORA2AADORA1 | |
| SCHEMBL25036001 | 0.87 | HSD17B10 (0.43) | CYP11B1SQORHSD17B10ADORA2AADORA1 | |
| SCHEMBL25774874 | 0.86 | ADORA2A (0.44) | SQORHSD17B10ADORA2AADORA1MAPK1 | |
| SCHEMBL26553152 | 0.86 | ADORA2A (0.44) | SQORHSD17B10ADORA2AADORA1MAPK1 | |
| SCHEMBL25037970 | 0.85 | HSD17B10 (0.41) | CYP11B1SQORHSD17B10ADORA2AADORA1 | |
| SCHEMBL25037984 | 0.85 | HSD17B10 (0.41) | CYP11B1SQORHSD17B10ADORA2AADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023018267-A1 | NOVEL COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-02-16 | — | — | WO | disclosed |