Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | FLT3 | P36888 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | AGXT | P21549 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 4/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6610235 | 1.00 | CYP2D6 (0.56) | CYP2D6HIF1AKDM4EFLT3LOXL2 | |
| SCHEMBL6612005 | 1.00 | CYP2D6 (0.56) | CYP2D6HIF1AKDM4EFLT3LOXL2 | |
| SCHEMBL29172969 | 0.81 | CYP2D6 (0.60) | CYP2D6HIF1AKDM4EFLT3LOXL2 | |
| SCHEMBL8158785 | 0.81 | CYP2D6 (0.56) | CYP2D6HIF1AKDM4EFLT3LOXL2 | |
| SCHEMBL24173635 | 0.81 | CYP2D6 (0.60) | CYP2D6HIF1AKDM4EFLT3LOXL2 | |
| SCHEMBL28594760 | 0.80 | CYP2D6 (0.44) | CYP2D6HIF1AKDM4EFLT3LOXL2 | |
| SCHEMBL6610233 | 0.77 | CYP2D6 (0.60) | CYP2D6HIF1AKDM4EHSD17B10TDP1 | |
| SCHEMBL6284878 | 0.77 | CYP2D6 (0.56) | CYP2D6HIF1AKDM4EFLT3LOXL2 | |
| SCHEMBL6608279 | 0.77 | CYP2D6 (0.60) | CYP2D6HIF1AKDM4EHSD17B10TDP1 | |
| SCHEMBL23239223 | 0.77 | CYP2D6 (0.52) | CYP2D6HIF1AKDM4EFLT3LOXL2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1458719-A1 | PYRIDOQUINOXALINE ANTIVIRALS | PHARMACIA & UPJOHN COMPANY (US) | 2004-09-22 | — | — | EP | disclosed |
| WO-2003053971-A1 | PYRIDOQUINOXALINE ANTIVIRALS | PHARMACIA & UPJOHN COMPANY (US) | 2003-07-03 | — | — | WO | disclosed |