Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4723973 | 0.92 | NPSR1 (0.49) | GAANPSR1NPC1RAB9AKDM4E | |
| SCHEMBL4718794 | 0.91 | NPSR1 (0.47) | GAANPSR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4724658 | 0.87 | NPSR1 (0.43) | GAANPSR1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL4722545 | 0.87 | GAA (0.50) | GAANPSR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4722543 | 0.86 | MEN1 (0.43) | GAANPSR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4719701 | 0.86 | GAA (0.41) | GAANPSR1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL4724434 | 0.83 | MEN1 (0.40) | GAANPSR1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL4722686 | 0.83 | NPSR1 (0.65) | GAANPSR1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL4722439 | 0.82 | MEN1 (0.43) | GAANPSR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4719649 | 0.82 | MEN1 (0.40) | GAANPSR1NPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |