Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.46 |
| ▸ | AMY1A | P0DUB6 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.43 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.43 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.43 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.43 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.43 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22537008 | 0.87 | NPC1 (0.55) | CD274NPC1RAB9AGRM2AMY1A | |
| SCHEMBL10340365 | 0.84 | AMY1A (0.50) | CD274RAB9AGRM2AMY1ACYP1A2 | |
| SCHEMBL14334814 | 0.79 | CD274 (0.43) | CD274NPC1RAB9AGRM2AMY1A | |
| SCHEMBL29048448 | 0.79 | RAB9A (0.51) | NPC1RAB9AAMY1AGAAMAPT | |
| SCHEMBL16855942 | 0.79 | CA12 (0.48) | CD274GRM2AMY1ACYP1A2CYP2A6 | |
| SCHEMBL1528920 | 0.79 | CD274 (0.48) | CD274NPC1RAB9AGRM2AMY1A | |
| SCHEMBL16852397 | 0.79 | AMY1A (0.51) | CD274NPC1RAB9AGRM2AMY1A | |
| SCHEMBL10000687 | 0.78 | ABL1 (0.52) | NPC1RAB9ANFE2L2MAPTKDM4E | |
| SCHEMBL16855819 | 0.77 | ERN1 (0.46) | NPC1RAB9AGRM2AMY1ACYP17A1 | |
| SCHEMBL30485666 | 0.76 | CD274 (0.46) | CD274NPC1RAB9AGRM2AMY1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2922933-B1 | POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS | MERCK PATENT GMBH (DE) | 2017-02-01 | — | — | EP | disclosed |