Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.31 |
| ▸ | MERTK | Q12866 | 1/20 | 0.31 |
| ▸ | GAS6 | Q14393 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5230010 | 0.84 | PDE4A (0.36) | KDRTLR7PDE4APDE4BPDE4C | |
| SCHEMBL5886505 | 0.74 | NPC1 (0.36) | KDRNPC1TP53TSHRSMN1; SMN2 | |
| SCHEMBL8302482 | 0.74 | KDR (0.34) | KDRNPC1TP53TSHRSMN1; SMN2 | |
| SCHEMBL5265789 | 0.72 | ALOX5AP (0.33) | — | |
| SCHEMBL5268564 | 0.72 | BRD4 (0.41) | KDRNPC1TP53TSHRSMN1; SMN2 | |
| SCHEMBL5265326 | 0.71 | NPC1 (0.32) | KDRNPC1TP53TSHRSMN1; SMN2 | |
| SCHEMBL6100048 | 0.70 | PDE4A (0.37) | KDRTLR7NPC1TP53TSHR | |
| SCHEMBL5260709 | 0.70 | PDCD1 (0.34) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4767966 | 0.70 | PDE10A (0.34) | KDRTLR7NPC1TP53TSHR | |
| SCHEMBL5262375 | 0.70 | ADORA2A (0.33) | TLR7 |
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-2004107863-A1 | SUSTITUTED IMIDAZOLOPYRAZINE AND TRIAZOLOPYRAZINE DERIVATIVES: GABAA RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 2004-12-16 | — | — | WO | disclosed |