Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22762273 | 0.95 | AHR (0.41) | AHRKMT2AKDM4EMAPK1NPC1 | |
| SCHEMBL22767252 | 0.92 | AHR (0.37) | AHRKMT2AKDM4EMAPK1RAB9A | |
| SCHEMBL22766889 | 0.91 | AHR (0.40) | AHRKMT2AKDM4EMAPK1NPC1 | |
| SCHEMBL22767055 | 0.90 | AHR (0.41) | AHRKMT2AKDM4EMAPK1NPC1 | |
| SCHEMBL22767143 | 0.89 | NPC1 (0.44) | AHRKMT2AKDM4EMAPK1NPC1 | |
| SCHEMBL22767243 | 0.88 | KDM4E (0.36) | AHRKMT2AKDM4EMAPK1NPC1 | |
| SCHEMBL22767149 | 0.87 | CYP1A2 (0.41) | AHRKMT2AKDM4EMAPK1NPC1 | |
| SCHEMBL22767105 | 0.85 | AHR (0.42) | AHRKMT2AKDM4EMAPK1NPC1 | |
| SCHEMBL25660703 | 0.85 | KDM4E (0.42) | AHRKMT2AKDM4EMAPK1NPC1 | |
| SCHEMBL25369249 | 0.85 | CYP1A1 (0.44) | AHRKMT2AMAPK1NPC1HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020246837-A9 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2021-06-03 | — | — | WO | disclosed |
| WO-2020246837-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2020-12-10 | — | — | WO | disclosed |