Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | NCF1 | P14598 | 1/20 | 0.49 |
| ▸ | NOS1 | P29475 | 2/20 | 0.48 |
| ▸ | NOS3 | P29474 | 1/20 | 0.48 |
| ▸ | NOS2 | P35228 | 1/20 | 0.48 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL790908 | 0.85 | HRH3 (0.52) | HRH3SMN1; SMN2HTTNCF1KDM4E | |
| SCHEMBL789600 | 0.84 | HRH3 (0.55) | HRH3SMN1; SMN2HTTKDM4EALDH1A1 | |
| SCHEMBL16883444 | 0.83 | HRH3 (0.59) | HRH3SMN1; SMN2HTTNCF1NOS1 | |
| SCHEMBL31082081 | 0.83 | HRH3 (0.51) | HRH3SMN1; SMN2HTTNCF1NOS1 | |
| SCHEMBL321512 | 0.83 | HRH3 (0.54) | HRH3SMN1; SMN2HTTNCF1NOS1 | |
| SCHEMBL14709470 | 0.80 | HRH3 (0.51) | HRH3SMN1; SMN2HTTNCF1NOS1 | |
| SCHEMBL20605142 | 0.80 | HRH3 (0.51) | HRH3SMN1; SMN2HTTNCF1NOS1 | |
| SCHEMBL20914856 | 0.80 | HRH3 (0.56) | HRH3SMN1; SMN2HTTNCF1NOS1 | |
| SCHEMBL24127978 | 0.79 | HRH3 (0.54) | HRH3SMN1; SMN2HTTNCF1NOS1 | |
| SCHEMBL14872333 | 0.79 | HRH3 (0.59) | HRH3SMN1; SMN2HTTNCF1NOS1 |
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 |