Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 2/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL7937861 | 0.85 | TLR9 (0.35) | HRH4CYP2D6CYP2C19IKBKBPDE4A | |
| SCHEMBL7943760 | 0.79 | CD38 (0.37) | CYP2C19ALDH1A1CYP1A2HSD17B10KDM4E | |
| SCHEMBL7945503 | 0.76 | TLR9 (0.37) | CYP2D6CYP2C19ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL7937747 | 0.72 | HSF1 (0.35) | CYP2D6ALDH1A1CYP1A2HSD17B10CYP2C9 | |
| SCHEMBL7943995 | 0.68 | HSF1 (0.36) | CYP2D6CYP2C19ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL7944093 | 0.66 | STIM1 (0.38) | ALDH1A1KDM4EADORA2BTLR9ADORA1 | |
| SCHEMBL6118631 | 0.60 | CYP2D6 (0.51) | HRH4CYP2D6CYP2C19IKBKBALDH1A1 | |
| SCHEMBL8130946 | 0.60 | PDE4A (0.56) | HSD17B10HPGDPDE4APDE4BPDE4C | |
| SCHEMBL20470731 | 0.59 | CYP2D6 (0.46) | HRH4CYP2D6CYP2C19IKBKBALDH1A1 | |
| SCHEMBL8132409 | 0.57 | PDE4A (0.50) | IKBKBCYP1A2HSD17B10PDE4APDE4B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010008775-A1 | AMINOPYRIDOPYRAZINONE DERIVATIVES FOR TREATING NEURODEGENERATIVE DISEASES | LIGAND PHARMACEUTICALS INC. (US) | 2010-01-21 | — | — | WO | disclosed |