Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
| ▸ | KDM1B | Q8NB78 | 2/20 | 0.39 |
| ▸ | BACE1 | P56817 | 5/20 | 0.39 |
| ▸ | PDE4A | P27815 | 2/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 3/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.35 |
| ▸ | GCGR | P47871 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3776523 | 0.84 | BACE1 (0.46) | KDM1ABACE1CTSDBACE2DHODH | |
| SCHEMBL3847657 | 0.78 | BACE1 (0.47) | BACE1CTSDBACE2MAPT | |
| SCHEMBL4386446 | 0.77 | BACE1 (0.47) | BACE1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3636810 | 0.74 | BACE1 (0.46) | KDM1ABACE1KCNH2CTSDBACE2 | |
| SCHEMBL3633229 | 0.74 | BACE1 (0.46) | KDM1AKDM1BBACE1PDE4APDE4B | |
| SCHEMBL3243724 | 0.72 | KDM1A (0.40) | KDM1ABACE1PDE4APDE4BPDE4C | |
| SCHEMBL4398010 | 0.71 | TEK (0.36) | BACE1KCNH2RPS6KA3CTSDBACE2 | |
| SCHEMBL3785651 | 0.70 | BACE1 (0.42) | BACE1KCNH2BACE2 | |
| SCHEMBL3773671 | 0.69 | CHRNA1 (0.32) | — | |
| SCHEMBL3780604 | 0.69 | BACE1 (0.46) | BACE1CTSDBACE2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7629356-B2 | Substituted pyrrolo[3,4-b]pyridinamines and pharmaceutical compositions | ASTRAZENECA AB (SE) | 2009-12-08 | — | — | US | disclosed |