Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.33 |
| ▸ | TTR | P02766 | 2/20 | 0.33 |
| ▸ | EYA3 | Q99504 | 2/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 3/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.30 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | GNG2 | P59768 | 1/20 | 0.30 |
| ▸ | GNB1 | P62873 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14281968 | 1.00 | GABRA1 (0.39) | GABRA1GABRB2HSD17B3ALDH1A1KDM4E | |
| SCHEMBL5442460 | 0.89 | CYP1B1 (0.34) | GABRA1GABRB2HSD17B3ALDH1A1HPGD | |
| SCHEMBL28174921 | 0.89 | MEN1 (0.35) | GABRA1GABRB2HSD17B3ALDH1A1KDM4E | |
| SCHEMBL28569644 | 0.83 | HSD17B3 (0.39) | GABRA1GABRB2HSD17B3ALDH1A1KDM4E | |
| SCHEMBL21037083 | 0.83 | HSD17B3 (0.40) | HSD17B3ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL16632779 | 0.77 | GABRA1 (0.36) | GABRA1GABRB2TBXA2R | |
| SCHEMBL2814697 | 0.77 | TYR (0.42) | ALDH1A1KDM4EMAPTESR1MEN1 | |
| SCHEMBL2815176 | 0.77 | TYR (0.42) | ALDH1A1KDM4EMAPTESR1MEN1 | |
| SCHEMBL2813389 | 0.77 | TYR (0.42) | ALDH1A1KDM4EMAPTESR1MEN1 | |
| SCHEMBL4585477 | 0.75 | TYR (0.41) | ALDH1A1KDM4EMAPTESR1MEN1 |
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-110249030-B | Organic electroluminescent device | 材料科学有限公司 | 2023-04-18 | — | — | CN | disclosed |