Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.46 |
| ▸ | MAPT | P10636 | 7/20 | 0.46 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.46 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | LPL | P06858 | 5/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 5/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17531628 | 0.88 | ALDH1A1 (0.47) | ALDH1A3ALDH1A1MAPTGAAHTT | |
| SCHEMBL790296 | 0.87 | ALDH1A1 (0.43) | ALDH1A3ALDH1A1MAPTGAALPL | |
| SCHEMBL1934039 | 0.87 | MAPT (0.40) | ALDH1A1MAPTMEN1KMT2AGAA | |
| SCHEMBL29554269 | 0.87 | MAPT (0.40) | ALDH1A1MAPTMEN1KMT2AGAA | |
| SCHEMBL14758377 | 0.87 | ALDH1A1 (0.45) | ALDH1A3ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL15788039 | 0.86 | LPL (0.36) | ALDH1A3ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL17403823 | 0.86 | HTR3A (0.50) | LPLLIPG | |
| Hydrochloric Acid SCHEMBL15774889 | 0.85 | HTR3A (0.49) | ALDH1A1MAPTMEN1KMT2AGAA | |
| SCHEMBL23850797 | 0.84 | S100B (0.50) | ALDH1A1MAPTMEN1KMT2AGAA | |
| SCHEMBL17531637 | 0.84 | ALDH1A1 (0.44) | ALDH1A1MAPTMEN1KMT2AGAA |
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 |