Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL5265326 | 0.89 | NPC1 (0.32) | KDRSMN1; SMN2NPC1TP53TSHR | |
| SCHEMBL5266946 | 0.86 | PDE1A (0.31) | FLT1CDK8CDK9LIMK1ROCK1 | |
| SCHEMBL5268564 | 0.84 | BRD4 (0.41) | KDRSMN1; SMN2NPC1TP53TSHR | |
| SCHEMBL8304594 | 0.83 | PDE1A (0.31) | — | |
| SCHEMBL5230010 | 0.76 | PDE4A (0.36) | KDRHSD17B10L3MBTL1KMT2ALMNA | |
| SCHEMBL6100048 | 0.76 | PDE4A (0.37) | KDRSMN1; SMN2NPC1TP53TSHR | |
| SCHEMBL8306194 | 0.74 | KDR (0.35) | KDRHSD17B10SMN1; SMN2NPC1TP53 | |
| SCHEMBL5886505 | 0.73 | NPC1 (0.36) | KDRHSD17B10SMN1; SMN2NPC1TP53 | |
| SCHEMBL8301579 | 0.72 | PDE1A (0.32) | MAPT | |
| SCHEMBL4767966 | 0.70 | PDE10A (0.34) | KDRHSD17B10SMN1; SMN2NPC1TP53 |
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 |