Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 5/20 | 0.54 |
| ▸ | HSD17B2 | P37059 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MPI | P34949 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 3/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.43 |
| ▸ | TNF | P01375 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29506864 | 0.89 | HSD17B1 (0.56) | HSD17B1HSD17B2ALDH1A1HPGDKDM4E | |
| SCHEMBL598398 | 0.88 | HSD17B1 (0.59) | HSD17B1HSD17B2ALDH1A1HPGDKDM4E | |
| SCHEMBL21203529 | 0.83 | HSD17B1 (0.48) | HSD17B1HSD17B2ALDH1A1HPGDKDM4E | |
| SCHEMBL2543830 | 0.82 | ALDH1A1 (0.57) | HSD17B1HSD17B2ALDH1A1HPGDKDM4E | |
| SCHEMBL12074740 | 0.82 | ALDH1A1 (0.57) | HSD17B1HSD17B2ALDH1A1HPGDKDM4E | |
| SCHEMBL23633512 | 0.81 | HSD17B1 (0.49) | HSD17B1HSD17B2ALDH1A1HPGDKDM4E | |
| SCHEMBL18965493 | 0.81 | HSD17B1 (0.49) | HSD17B1HSD17B2ALDH1A1HPGDKDM4E | |
| SCHEMBL28364735 | 0.81 | CA12 (0.49) | ALDH1A1HPGDKDM4EMAPTMEN1 | |
| SCHEMBL623148 | 0.80 | TNF (0.52) | ALDH1A1HPGDKDM4EMAPTMEN1 | |
| SCHEMBL29463735 | 0.80 | TNF (0.52) | ALDH1A1HPGDKDM4EMAPTMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20190352566-A1 | CHIRAL COMPOUND, LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME, OPTICALLY ANISOTROPIC BODY, AND LIQUID CRYSTAL DISPLAY DEVICE | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) | 2019-11-21 | — | — | US | disclosed |
| US-10457870-B1 | Chiral compound, liquid crystal composition containing the same, optically anisotropic body, and liquid crystal display device | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) | 2019-10-29 | — | — | US | disclosed |