Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRS3 | P32247 | 9/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.34 |
| ▸ | NAMPT | P43490 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13477501 | 0.89 | NPC1 (0.48) | BRS3NPC1RAB9AKDM4EHTT | |
| SCHEMBL19085191 | 0.86 | BRS3 (0.47) | BRS3NPC1RAB9AKDM4EHTT | |
| SCHEMBL19085337 | 0.84 | BRS3 (0.49) | BRS3NPC1RAB9AKDM4EHTT | |
| SCHEMBL19085342 | 0.83 | BRS3 (0.56) | BRS3NPC1RAB9AKDM4EHTT | |
| SCHEMBL20621045 | 0.83 | BRS3 (0.44) | BRS3NPC1RAB9AKDM4EHTT | |
| SCHEMBL19085243 | 0.82 | BRS3 (0.49) | BRS3NPC1RAB9AHTTALDH1A1 | |
| SCHEMBL20620617 | 0.82 | BRS3 (0.44) | BRS3NPC1RAB9AKDM4EHTT | |
| SCHEMBL20620524 | 0.82 | BRS3 (0.44) | BRS3NPC1RAB9AKDM4EHTT | |
| SCHEMBL19085244 | 0.80 | BRS3 (0.44) | BRS3NPC1RAB9AKDM4EHTT | |
| SCHEMBL13477546 | 0.80 | BRS3 (0.41) | BRS3NPC1RAB9AKDM4EHTT |
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-2149561-A1 | TETRAHYDROISOQUINOLIN-1-ONE DERIVATIVE OR SALT THEREOF | Astellas Pharma Inc. (JP) | 2010-02-03 | — | — | EP | disclosed |