Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | BACE1 | P56817 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.37 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21061485 | 0.86 | KDM4E (0.62) | KDM4EALDH1A1GAABACE1HTT | |
| SCHEMBL29706946 | 0.86 | KDM4E (0.62) | KDM4EALDH1A1GAABACE1HTT | |
| SCHEMBL9005125 | 0.81 | BACE1 (0.42) | KDM4EALDH1A1GAABACE1PABPC1 | |
| SCHEMBL789995 | 0.79 | KDM4E (0.62) | KDM4EALDH1A1GAABACE1MEN1 | |
| SCHEMBL7264580 | 0.79 | ALDH1A1 (0.41) | KDM4EALDH1A1GAABACE1HTT | |
| SCHEMBL807478 | 0.79 | KDM4E (0.62) | KDM4EALDH1A1GAABACE1HTT | |
| SCHEMBL29904585 | 0.77 | ALDH1A1 (1.00) | KDM4EALDH1A1GAAMEN1MAPT | |
| SCHEMBL941858 | 0.77 | ALDH1A1 (1.00) | KDM4EALDH1A1GAAMEN1MAPT | |
| SCHEMBL5775666 | 0.76 | BACE1 (0.57) | KDM4EALDH1A1BACE1HTTPABPC1 | |
| SCHEMBL24091986 | 0.76 | KDM4E (0.57) | KDM4EALDH1A1GAAMEN1MAPT |
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 2 patents. 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 |
| WO-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |