Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | KDM1A | O60341 | 3/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21338798 | 1.00 | NPC1 (0.59) | NPC1RAB9AKDM1AMAOBBRD4 | |
| SCHEMBL19159432 | 0.91 | NPC1 (0.47) | NPC1RAB9ANOTUMCYP2D6ESR2 | |
| SCHEMBL15757454 | 0.89 | NPC1 (0.70) | NPC1RAB9AKDM1AMAOBBRD4 | |
| SCHEMBL18411594 | 0.87 | SLC18A3 (0.54) | NPC1RAB9ASLC18A3SIGMAR1GRIN2B | |
| Ammonia Solution, Strong SCHEMBL2454353 | 0.87 | NPC1 (0.68) | NPC1RAB9AKDM1AMAOBBRD4 | |
| SCHEMBL21510991 | 0.84 | NPC1 (0.45) | NPC1RAB9AKDM1AMAOBBRD4 | |
| SCHEMBL21556845 | 0.84 | ESR2 (0.46) | NPC1RAB9ASLC18A3SIGMAR1NOTUM | |
| SCHEMBL19393897 | 0.83 | NOTUM (0.50) | NPC1RAB9ANOTUMESR2 | |
| SCHEMBL20080961 | 0.83 | NOTUM (0.50) | NPC1RAB9ANOTUMESR2 | |
| SCHEMBL26560081 | 0.83 | NPC1 (0.42) | NPC1RAB9ANOTUMESR2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4273207-A1 | LIQUID-CRYSTAL MEDIUM | Merck Patent GmbH (DE) | 2023-11-08 | — | — | EP | disclosed |
| EP-3418350-B1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORP (JP) | 2020-12-23 | — | — | EP | disclosed |
| EP-2824161-B1 | LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL DISPLAY ELEMENT OBTAINED USING SAME | DAINIPPON INK & CHEMICALS (JP) | 2019-01-23 | — | — | EP | disclosed |
| EP-3075816-B1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORP (JP) | 2018-05-23 | — | — | EP | disclosed |