Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | PON1 | P27169 | 1/20 | 0.39 |
| ▸ | NQO1 | P15559 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11976504 | 0.83 | MCL1 (0.55) | KDM4EALDH1A1MCL1CSNK2A2CSNK2B | |
| SCHEMBL25878382 | 0.81 | MAOA (0.40) | KDM4EALDH1A1MCL1MAOAHPGD | |
| SCHEMBL17637325 | 0.81 | ALDH1A1 (0.60) | KDM4EALDH1A1MCL1MAOAHPGD | |
| SCHEMBL25878377 | 0.79 | MCL1 (0.39) | KDM4EALDH1A1MCL1HPGDHSD17B10 | |
| SCHEMBL25878384 | 0.79 | MAOA (0.38) | KDM4EALDH1A1MAOAHPGDTSHR | |
| SCHEMBL25878383 | 0.78 | MAOA (0.37) | KDM4EALDH1A1MAOAHPGDHSD17B10 | |
| SCHEMBL10079563 | 0.75 | KDM4E (0.51) | KDM4EALDH1A1MAOAHPGDHSD17B10 | |
| SCHEMBL25878380 | 0.75 | MAOA (0.41) | KDM4EALDH1A1MAOAHPGDHSD17B10 | |
| SCHEMBL21663117 | 0.75 | ALDH1A1 (0.46) | KDM4EALDH1A1MCL1MAOAHPGD | |
| SCHEMBL21451570 | 0.72 | MCL1 (0.50) | KDM4EALDH1A1MCL1ESR2ESR1 |
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-2023134594-A1 | NEGATIVE DIELECTRIC ANISOTROPIC LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIER, AND LIQUID CRYSTAL DISPLAY COMPONENT | 烟台显华科技集团股份有限公司 | 2023-07-20 | — | — | WO | disclosed |