Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP3 | P05413 | 1/20 | 0.38 |
| ▸ | FABP4 | P15090 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | TNKS | O95271 | 1/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | MAP2 | P11137 | 1/20 | 0.35 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CTSA | P10619 | 2/20 | 0.34 |
| ▸ | PLA2G2A | P14555 | 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 | |
|---|---|---|---|---|
| SCHEMBL2823282 | 0.91 | ENPP1 (0.39) | PTGDR2TNKSTNKS2PARP2DHODH | |
| SCHEMBL2824685 | 0.90 | KDM4E (0.41) | FABP3FABP4PTGDR2TNKSTNKS2 | |
| SCHEMBL2825609 | 0.90 | SMN1; SMN2 (0.44) | FABP3FABP4NR1H2DHODHADORA2A | |
| SCHEMBL2821965 | 0.90 | FABP3 (0.39) | FABP3FABP4PTGDR2MAP2ADORA2A | |
| SCHEMBL2826082 | 0.88 | ENPP1 (0.43) | TNKSTNKS2PARP2ADORA2AADORA1 | |
| SCHEMBL2824206 | 0.88 | DHODH (0.37) | PTGDR2NR1H2DHODHADORA2AADORA1 | |
| SCHEMBL2825639 | 0.87 | NR1H2 (0.40) | PTGDR2NR1H2 | |
| SCHEMBL2826114 | 0.83 | CYP1A2 (0.39) | TNKSTNKS2PARP2NR1H2DHODH | |
| SCHEMBL2824267 | 0.80 | ALDH1A1 (0.48) | FABP3FABP4NR1H2SMN1; SMN2GAA | |
| SCHEMBL2825663 | 0.80 | KMT2A (0.41) | FABP3FABP4PTGDR2NR1H2MAP2 |
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 |