Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | GPR68 | Q15743 | 5/20 | 0.56 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.56 |
| ▸ | HTR2B | P41595 | 1/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | APP | P05067 | 2/20 | 0.48 |
| ▸ | TPH1 | P17752 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3301514 | 0.82 | NPSR1 (0.74) | NPSR1GPR68ADORA2AHTR2BHTR1A | |
| SCHEMBL6727019 | 0.82 | NPSR1 (0.74) | NPSR1GPR68ADORA2AHTR2BHTR1A | |
| Hydrochloric Acid SCHEMBL9247173 | 0.80 | NPSR1 (0.72) | NPSR1GPR68ADORA2AHTR2BHTR1A | |
| SCHEMBL27603024 | 0.80 | RAB9A (0.68) | ADORA2ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4468113 | 0.79 | NPSR1 (0.51) | NPSR1GPR68ADORA2AHTR2BSMN1; SMN2 | |
| SCHEMBL20355131 | 0.74 | ALDH1A1 (0.74) | NPSR1GPR68SMN1; SMN2 | |
| SCHEMBL29609599 | 0.74 | NPSR1 (0.64) | NPSR1GPR68ADORA2AHTR2BHTR1A | |
| SCHEMBL14869439 | 0.74 | GAA (0.71) | NPSR1GPR68ADORA2AHTR2BHTR1A | |
| SCHEMBL14869402 | 0.74 | NPSR1 (0.64) | NPSR1GPR68ADORA2AHTR2BHTR1A | |
| SCHEMBL3298289 | 0.72 | KCNH3 (0.73) | NPSR1APPPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2070934-A1 | Synthesis of biguanidines and triazines, and biguanidino-aluminium complexes as intermediates | Bayer CropScience AG (DE) | 2009-06-17 | — | — | EP | disclosed |