Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL26553187 | 0.95 | ALDH1A1 (0.43) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL25774192 | 0.95 | ALDH1A1 (0.43) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL26582017 | 0.91 | XDH (0.43) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL26582013 | 0.91 | XDH (0.44) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL26582015 | 0.91 | XDH (0.45) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL26582014 | 0.90 | ALDH1A1 (0.46) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL25774930 | 0.89 | ALDH1A1 (0.43) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL26553184 | 0.87 | ALDH1A1 (0.41) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL25774993 | 0.87 | XDH (0.43) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL25774348 | 0.86 | ALDH1A1 (0.43) | ALDH1A1KDM4EHTTRXFP1LMNA |
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-2023195735-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-10-12 | — | — | WO | disclosed |