Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.44 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 3/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | CTSD | P07339 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.40 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL26048228 | 0.88 | CD274 (0.42) | ESR2MCL1ENPP3ENPP1HTR7 | |
| SCHEMBL26820200 | 0.82 | ESR2 (0.52) | ESR2MCL1ENPP3ENPP1HTR7 | |
| SCHEMBL21730827 | 0.81 | HTR7 (0.50) | MCL1HTR7CA12CA9PDK2 | |
| SCHEMBL4411745 | 0.80 | MEN1 (0.47) | ESR2BACE1NPC1ALDH1A1HPGD | |
| SCHEMBL30323675 | 0.80 | MEN1 (0.47) | ESR2BACE1NPC1ALDH1A1HPGD | |
| SCHEMBL3294993 | 0.80 | CA12 (0.55) | ESR2MCL1ENPP3ENPP1HTR7 | |
| Tannin Pyrogallol SCHEMBL28281926 | 0.80 | CA12 (0.55) | ESR2MCL1ENPP3ENPP1HTR7 | |
| SCHEMBL616 | 0.79 | ESR2 (0.54) | ESR2MCL1ENPP3ENPP1HTR7 | |
| SCHEMBL29706107 | 0.79 | ESR2 (0.54) | ESR2MCL1ENPP3ENPP1HTR7 | |
| SCHEMBL20550243 | 0.78 | ESR2 (0.61) | ESR2MCL1ENPP3ENPP1HTR7 |
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 |
|---|---|---|---|---|---|---|---|
| US-20230265345-A1 | LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND APPLICATION OF LIQUID CRYSTAL COMPOSITION | BEIJING BAYI SPACE LCD TECHNOLOGY CO., LTD. (CN) | 2023-08-24 | — | — | US | disclosed |