Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.51 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.51 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MPI | P34949 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21203331 | 1.00 | CYP1A2 (0.52) | CYP1A2HSD17B1HSD17B2CA12CA1 | |
| SCHEMBL598398 | 0.91 | HSD17B1 (0.59) | CYP1A2HSD17B1HSD17B2CA12CA1 | |
| SCHEMBL30776967 | 0.87 | HSD17B1 (0.49) | CYP1A2HSD17B1HSD17B2CA12CA1 | |
| SCHEMBL26563969 | 0.86 | CA12 (0.51) | CYP1A2CA12CA1CA2CA9 | |
| SCHEMBL21203519 | 0.86 | CYP1A2 (0.52) | CYP1A2HSD17B1HSD17B2CA12CA1 | |
| SCHEMBL24945273 | 0.86 | CYP1A2 (0.52) | CYP1A2HSD17B1HSD17B2CA12CA1 | |
| SCHEMBL30956317 | 0.86 | CYP1A2 (0.52) | CYP1A2HSD17B1HSD17B2CA12CA1 | |
| SCHEMBL31458504 | 0.86 | CYP1A2 (0.52) | CYP1A2HSD17B1HSD17B2CA12CA1 | |
| SCHEMBL29506864 | 0.85 | HSD17B1 (0.56) | CYP1A2HSD17B1HSD17B2CA12CA1 | |
| SCHEMBL21203579 | 0.84 | CYP1A2 (0.54) | CYP1A2HSD17B1HSD17B2GPR84MAP4K4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-119968354-A | Compound, organic electroluminescent element, and electronic device | 保土谷化学工业株式会社 | 2025-05-09 | — | — | CN | disclosed |