Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | NOS3 | P29474 | 2/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | NOS2 | P35228 | 2/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | DHFR | P00374 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | GLP1R | P43220 | 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 | |
|---|---|---|---|---|
| SCHEMBL28587839 | 1.00 | PDE10A (0.41) | PDE10ABACE1KDM4ECYP1A2NOS3 | |
| SCHEMBL28580709 | 0.80 | PDE10A (0.53) | PDE10AKDM4ECYP1A2ALDH1A1MAPT | |
| SCHEMBL29639039 | 0.75 | ALDH1A1 (0.39) | PDE10AKDM4ECYP1A2NOS3NOS1 | |
| SCHEMBL28603233 | 0.75 | ALDH1A1 (0.39) | PDE10AKDM4ECYP1A2NOS3NOS1 | |
| SCHEMBL28603226 | 0.74 | TLR9 (0.47) | PDE10AKDM4ENOS3NOS1NOS2 | |
| SCHEMBL28580708 | 0.74 | PDE10A (0.46) | PDE10AKDM4ENOS3NOS1NOS2 | |
| SCHEMBL9971272 | 0.73 | PDE10A (0.77) | PDE10AKDM4ECYP1A2CYP2C9HIF1A | |
| SCHEMBL21264273 | 0.73 | RAB9A (0.55) | PDE10AKDM4EALDH1A1MAPT | |
| SCHEMBL24446591 | 0.72 | NOS3 (0.35) | BACE1KDM4ENOS3NOS1NOS2 | |
| SCHEMBL24253449 | 0.72 | PDE10A (0.34) | PDE10AMAPTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113087674-B | Method for synthesizing quinoxaline compound under catalysis of visible light induced photosensitizer | 河南大学 | 2022-06-17 | — | — | CN | disclosed |