Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.56 |
| ▸ | DRD3 | P35462 | 3/20 | 0.56 |
| ▸ | DRD4 | P21917 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | GFER | P55789 | 2/20 | 0.52 |
| ▸ | LTA4H | P09960 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 2/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR7 | P34969 | 1/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29675362 | 1.00 | DRD2 (0.56) | DRD2DRD3DRD4HSD17B10GFER | |
| SCHEMBL28610812 | 0.84 | LTA4H (0.58) | DRD2DRD3DRD4LTA4HKDM4E | |
| SCHEMBL29995464 | 0.84 | LTA4H (0.58) | DRD2DRD3DRD4LTA4HKDM4E | |
| SCHEMBL29675387 | 0.81 | FDPS (0.56) | DRD2DRD3HSD17B10KDM4EALDH1A1 | |
| SCHEMBL28616598 | 0.81 | FDPS (0.56) | DRD2DRD3HSD17B10KDM4EALDH1A1 | |
| SCHEMBL5182203 | 0.81 | SIGMAR1 (0.61) | DRD2HSD17B10GFERMAPTSMN1; SMN2 | |
| SCHEMBL28631507 | 0.79 | RXFP1 (0.62) | GFERKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL29675400 | 0.79 | RXFP1 (0.62) | GFERKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL29675679 | 0.78 | NPC1 (0.51) | DRD2DRD3HSD17B10KDM4EALDH1A1 | |
| SCHEMBL28612617 | 0.78 | NPC1 (0.51) | DRD2DRD3HSD17B10KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113292515-B | Urea compound containing piperazine group and preparation method and application thereof | 沈阳药科大学 | 2022-05-20 | — | — | CN | disclosed |
| CN-113292515-A | Urea compound containing piperazine group and preparation method and application thereof | 沈阳药科大学 | 2021-08-24 | — | — | CN | disclosed |