Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 6/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.53 |
| ▸ | GAA | P10253 | 4/20 | 0.53 |
| ▸ | IKBKB | O14920 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7891555 | 0.78 | ALDH1A1 (0.54) | TLR8ALDH1A1GAAIKBKBKDM4E | |
| SCHEMBL715554 | 0.78 | ALDH1A1 (0.58) | TLR8ALDH1A1GAAKDM4EMAPT | |
| SCHEMBL30081463 | 0.78 | ALDH1A1 (0.58) | TLR8ALDH1A1GAAKDM4EMAPT | |
| SCHEMBL28155296 | 0.78 | TLR8 (0.50) | TLR8ALDH1A1GAAIKBKBKDM4E | |
| SCHEMBL790844 | 0.78 | BACE1 (0.50) | TLR8ALDH1A1KDM4EMAPTHTT | |
| SCHEMBL372264 | 0.77 | ALDH1A1 (0.62) | ALDH1A1GAAKDM4EMAPTHPGD | |
| SCHEMBL11109074 | 0.77 | ALDH1A1 (0.53) | TLR8ALDH1A1GAAIKBKBKDM4E | |
| SCHEMBL372183 | 0.77 | ALDH1A1 (0.53) | TLR8ALDH1A1GAAIKBKBKDM4E | |
| SCHEMBL29953988 | 0.77 | ALDH1A1 (0.53) | ALDH1A1GAAIKBKBKDM4EMAPT | |
| SCHEMBL6340621 | 0.77 | ALDH1A1 (0.53) | ALDH1A1GAAIKBKBKDM4EMAPT |
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-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |