Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA6 | P23280 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
| ▸ | PRKDC | P78527 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22145657 | 0.92 | CA12 (0.44) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL19763396 | 0.83 | ALDH1A1 (0.45) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL16981609 | 0.72 | CA12 (0.43) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL347719 | 0.71 | CA12 (0.54) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL16981578 | 0.71 | APP (0.42) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL12240977 | 0.70 | ALDH1A1 (0.55) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL1794001 | 0.69 | TAAR1 (0.45) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL9464272 | 0.69 | MAOB (0.70) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL2212307 | 0.68 | LTA4H (0.46) | MAPTCA12CA1CA2CA6 | |
| SCHEMBL1794141 | 0.68 | CA12 (0.47) | ALDH1A1KDM4EHPGDTSHRHSD17B10 |
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-2020127172-A1 | LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME AND COMPOUNDS | MERCK PATENT GMBH (DE) | 2020-06-25 | — | — | WO | disclosed |