Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | APP | P05067 | 2/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | GALR3 | O60755 | 1/20 | 0.33 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.33 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21769799 | 0.73 | PSMB5 (0.37) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL4541350 | 0.71 | AKR1B10 (0.36) | NPC1RAB9AKDM4EAPPPAX8 | |
| SCHEMBL24601717 | 0.71 | KDM4E (0.40) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL17561708 | 0.68 | KDM4E (0.38) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL1285587 | 0.68 | NQO2 (0.41) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL6858521 | 0.67 | ALDH1A1 (0.49) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL16426895 | 0.66 | ALDH1A1 (0.36) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL32661907 | 0.66 | DPP4 (0.38) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL29308750 | 0.66 | CYP2A6 (0.50) | KDM4EMAPTALDH1A1HPGDMAOB | |
| SCHEMBL958660 | 0.65 | RAB9A (0.58) | NPC1RAB9AKDM4EMAPTALDH1A1 |
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-2020040434-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2020-02-27 | — | — | WO | disclosed |