Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.36 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | PRCP | P42785 | 2/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MLYCD | O95822 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2828042 | 0.95 | MAPT (0.37) | ALDH1A1MCHR1MAPTMLYCD | |
| SCHEMBL2825542 | 0.90 | KIF18A (0.35) | ALDH1A1MCHR1 | |
| SCHEMBL2821184 | 0.86 | SMN1; SMN2 (0.37) | ALDH1A1DHODHMAPT | |
| SCHEMBL2822062 | 0.85 | KDM4E (0.38) | ALDH1A1DHODHMAPT | |
| SCHEMBL2825467 | 0.85 | KDM4E (0.38) | ALDH1A1DHODHMAPT | |
| SCHEMBL2824985 | 0.84 | HPGD (0.42) | ALDH1A1MAPT | |
| SCHEMBL2828012 | 0.83 | ALDH1A1 (0.41) | ALDH1A1MCHR1OPRM1OPRD1OPRK1 | |
| SCHEMBL2824028 | 0.82 | FABP3 (0.43) | ALDH1A1MAPT | |
| SCHEMBL2825677 | 0.81 | FABP3 (0.45) | ALDH1A1MAPT | |
| SCHEMBL2821880 | 0.81 | FABP3 (0.45) | ALDH1A1MAPT |
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 |