Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.49 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.49 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.49 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | PIM1 | P11309 | 4/20 | 0.45 |
| ▸ | GSK3A | P49840 | 3/20 | 0.45 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.45 |
| ▸ | CDKN1A | P38936 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.43 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7400411 | 0.88 | KDM4E (0.49) | TLR8MAP2K1CLK4DYRK1BGAA | |
| SCHEMBL7370182 | 0.87 | MAP2K1 (0.49) | TLR8MAP2K1CLK4DYRK1BGAA | |
| SCHEMBL7400296 | 0.87 | DYRK1B (0.49) | TLR8MAP2K1CLK4DYRK1BGAA | |
| SCHEMBL7366563 | 0.82 | KDM4E (0.67) | TLR8CDKN1AKDM4E | |
| SCHEMBL7362717 | 0.81 | TLR8 (0.55) | TLR8MAP2K1CLK4DYRK1BGAA | |
| SCHEMBL7360098 | 0.81 | MAP2K1 (0.56) | TLR8MAP2K1CLK4DYRK1BGAA | |
| SCHEMBL7394656 | 0.81 | MAP2K1 (0.51) | TLR8MAP2K1CLK4DYRK1BGAA | |
| SCHEMBL11167079 | 0.81 | MAP2K1 (0.59) | TLR8MAP2K1CLK4DYRK1BGAA | |
| SCHEMBL11162191 | 0.80 | KDM4E (0.65) | TLR8MAP2K1CLK4DYRK1BGAA | |
| SCHEMBL7366580 | 0.80 | MAP2K1 (0.55) | TLR8MAP2K1CLK4DYRK1BGAA |
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-4521422-A | ANTICONVULSANT, ANTIEPILEPTIC AGENTS, SEDATIVES, MUSCLE RELAXANTS | AMERICAN CYANAMID COMPANY (US) | 1985-06-04 | — | — | US | disclosed |
| EP-0129847-A2 | Aryl and heteroaryl[7-(aryl and heteroaryl)-pyrazolo-[1,5-a]-pyrimidin-3-yl]methanones | AMERICAN CYANAMID COMPANY (US) | 1985-01-02 | — | — | EP | disclosed |