Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.39 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 11/20 | 0.36 |
| ▸ | ESR1 | P03372 | 9/20 | 0.36 |
| ▸ | TYR | P14679 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | ESRRB | O95718 | 1/20 | 0.33 |
| ▸ | ESRRA | P11474 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA3 | P07451 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9635381 | 0.87 | ESR1 (0.44) | ARESR2ESR1ESRRBESRRA | |
| SCHEMBL13756111 | 0.83 | FFAR1 (0.36) | ARSNCACA9CA12CA2 | |
| SCHEMBL14417362 | 0.78 | AR (0.42) | ARSNCAESR2ESR1TYR | |
| SCHEMBL9635251 | 0.78 | ALDH1A1 (0.47) | — | |
| SCHEMBL13756110 | 0.77 | TSHR (0.42) | — | |
| SCHEMBL16143477 | 0.74 | SNCA (0.40) | ARSNCAESR2ESR1TYR | |
| SCHEMBL22904093 | 0.74 | ESR2 (0.49) | ARSNCAESR2ESR1TYR | |
| SCHEMBL11206833 | 0.74 | GABRA1 (0.42) | ARSNCAESR2ESR1TYR | |
| SCHEMBL9635428 | 0.73 | HSD17B10 (0.41) | — | |
| SCHEMBL29595425 | 0.73 | HSD17B10 (0.45) | ESR2ESR1TYRCA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0283326-B1 | LIQUID CRYSTAL COMPOUNDS WITH 4-(OPTICALLY ACTIVE ALKYL)-3-CYANOPHENYL GROUPS | Chisso Corporation (JP) | 1992-06-24 | — | — | EP | disclosed |
| US-4913838-A | LARGE SPONTANEOUS POLARIZATION VALUE | CHISSO CORPORATION (JP) | 1990-04-03 | — | — | US | disclosed |