Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 5/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.44 |
| ▸ | RELA | Q04206 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | AR | P10275 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ACACA | Q13085 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL19618371 | 0.94 | NPC1 (0.47) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL19618324 | 0.93 | NPC1 (0.49) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL19618361 | 0.93 | NPC1 (0.49) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL19618580 | 0.92 | ACACA (0.43) | CYP1A1CYP1B1NPC1RAB9AKDM4E | |
| SCHEMBL19618281 | 0.92 | KDM4E (0.50) | CYP1A1CYP1B1NPC1RAB9AKDM4E | |
| SCHEMBL19618393 | 0.90 | NPC1 (0.49) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL19618302 | 0.88 | CYP1A1 (0.50) | CYP1A1CYP1B1KDM4EALDH1A1MEN1 | |
| SCHEMBL19618334 | 0.86 | CYP1A1 (0.49) | CYP1A1CYP1B1KDM4EALDH1A1MEN1 | |
| SCHEMBL19618299 | 0.86 | CYP1A1 (0.52) | CYP1A1CYP1B1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL19618300 | 0.86 | CYP1A1 (0.46) | CYP1A1CYP1B1KDM4EALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9825242-B2 | Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode | CHEIL INDUSTRIES, INC. (KR) | 2017-11-21 | — | — | US | disclosed |
| US-9825242-B2 | Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode | CHEIL INDUSTRIES, INC. (KR) | 2017-11-21 | — | — | US | disclosed |