Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.37 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | PLG | P00747 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1692766 | 0.79 | GRM5 (0.49) | TMPRSS4ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL24370928 | 0.79 | CXCR1 (0.40) | TMPRSS4ALDH1A1GFERMAPTKDM4E | |
| SCHEMBL3955354 | 0.77 | ALDH1A1 (0.64) | TMPRSS4ALDH1A1GFERMAPTKDM4E | |
| SCHEMBL14850885 | 0.75 | KMT2A (0.56) | ALDH1A1MAPTMEN1KMT2AGAA | |
| SCHEMBL23069420 | 0.75 | CTSD (0.55) | ALDH1A1MAPTMEN1KMT2AGAA | |
| SCHEMBL29546299 | 0.75 | CTSD (0.55) | ALDH1A1MAPTMEN1KMT2AGAA | |
| SCHEMBL30474051 | 0.74 | PTGDR2 (0.43) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL25215887 | 0.74 | PTGDR2 (0.43) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL6461738 | 0.72 | CTSD (0.50) | ALDH1A1GFERMAPTKDM4EMEN1 | |
| SCHEMBL24371182 | 0.71 | GPR6 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2079734-A1 | OXADIAZOLE AND THIADIAZOLE COMPOUNDS AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS | NeuroSearch A/S (DK) | 2009-07-22 | — | — | EP | disclosed |
| WO-2008049864-A1 | OXADIAZOLE AND THIADIAZOLE COMPOUNDS AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS | NEUROSEARCH A/S (DK) | 2008-05-02 | — | — | WO | disclosed |