Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12821098 | 0.69 | SIGMAR1 (0.40) | KDM4ETDP1HPGDGAALMNA | |
| SCHEMBL28485542 | 0.68 | SIGMAR1 (0.39) | KDM4ETDP1HPGDGAALMNA | |
| SCHEMBL30309571 | 0.68 | SIGMAR1 (0.39) | KDM4ETDP1HPGDGAALMNA | |
| SCHEMBL28975392 | 0.68 | SIGMAR1 (0.39) | KDM4ETDP1HPGDGAALMNA | |
| SCHEMBL11748730 | 0.65 | MEN1 (0.48) | ALDH1A1KDM4ETDP1HPGDGAA | |
| SCHEMBL11568355 | 0.65 | MAPT (0.40) | ALDH1A1KDM4ETDP1GAALMNA | |
| SCHEMBL16281050 | 0.65 | ALDH1A1 (0.44) | ALDH1A1KDM4ETDP1HPGDGAA | |
| SCHEMBL21865034 | 0.60 | POLB (0.40) | ALDH1A1KDM4ETDP1HPGDGAA | |
| SCHEMBL1408982 | 0.59 | KDM4E (0.45) | ALDH1A1KDM4ETDP1HPGDGAA | |
| Phenanthrene SCHEMBL201780 | 0.59 | ALDH1A1 (0.92) | ALDH1A1TDP1HPGDCYP2A6TSHR |
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-117209415-A | Organic compound, light-emitting device, and light-receiving device | 株式会社半导体能源研究所 | 2023-12-12 | — | — | CN | disclosed |