Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | TACR1 | P25103 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | FABP3 | P05413 | 2/20 | 0.35 |
| ▸ | FABP4 | P15090 | 2/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.35 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | RBP4 | P02753 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2821290 | 0.92 | DGAT1 (0.38) | GAAMAPTNPSR1SMN1; SMN2TACR1 | |
| SCHEMBL2824314 | 0.92 | ENPP1 (0.35) | GAAMAPTNPSR1SMN1; SMN2TACR1 | |
| SCHEMBL2824028 | 0.88 | FABP3 (0.43) | GAAMAPTNPSR1SMN1; SMN2TACR1 | |
| SCHEMBL2821880 | 0.87 | FABP3 (0.45) | GAAMAPTNPSR1SMN1; SMN2TACR1 | |
| SCHEMBL2825677 | 0.87 | FABP3 (0.45) | GAAMAPTNPSR1SMN1; SMN2TACR1 | |
| SCHEMBL2826514 | 0.86 | TACR1 (0.42) | GAAMAPTNPSR1SMN1; SMN2TACR1 | |
| SCHEMBL2826068 | 0.85 | NPSR1 (0.43) | GAAMAPTNPSR1SMN1; SMN2LMNA | |
| SCHEMBL2824392 | 0.85 | RAF1 (0.37) | TACR1ENPP1 | |
| SCHEMBL2825178 | 0.84 | CHEK2 (0.41) | TACR1 | |
| SCHEMBL2828042 | 0.82 | MAPT (0.37) | GAAMAPTNPSR1SMN1; SMN2TACR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1809605-B1 | QUINOLINES AS ALLOSTERIC ENHANCERS OF THE GABA-B RECEPTORS | HOFFMANN LA ROCHE (CH) | 2010-08-11 | — | — | EP | claimed |