Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ3 | O43525 | 2/20 | 0.38 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.35 |
| ▸ | GCGR | P47871 | 1/20 | 0.35 |
| ▸ | GIPR | P48546 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 2/20 | 0.34 |
| ▸ | MOGAT2 | Q3SYC2 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 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 | |
|---|---|---|---|---|
| SCHEMBL8768428 | 1.00 | KCNQ3 (0.38) | KCNQ3KCNQ2GRIN2BKDM4EALDH1A1 | |
| SCHEMBL8768402 | 0.98 | KCNQ3 (0.38) | KCNQ3KCNQ2GRIN2BKDM4EALDH1A1 | |
| SCHEMBL8768412 | 0.98 | KCNQ3 (0.38) | KCNQ3KCNQ2GRIN2BKDM4EALDH1A1 | |
| SCHEMBL8767249 | 0.95 | KCNQ3 (0.39) | KCNQ3KCNQ2GRIN2BKDM4EALDH1A1 | |
| SCHEMBL8767242 | 0.95 | KCNQ3 (0.39) | KCNQ3KCNQ2GRIN2BKDM4EALDH1A1 | |
| SCHEMBL7907856 | 0.91 | SCN9A (0.37) | GRIN2BMMP12SLC6A4SLC6A3CHRM2 | |
| SCHEMBL7907854 | 0.91 | SCN9A (0.37) | GRIN2BMMP12SLC6A4SLC6A3CHRM2 | |
| SCHEMBL16579162 | 0.89 | SCN9A (0.36) | GRIN2BMMP12CHRM2CHRM5CHRM1 | |
| SCHEMBL16579012 | 0.87 | CYP2C9 (0.38) | GRIN2BALDH1A1GCGRMMP12CHRM2 | |
| SCHEMBL8052426 | 0.86 | CHRM4 (0.35) | SCN10AMMP12CHRM2CHRM5CHRM1 |
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-0789067-A1 | Cyclopentyl derivatives useful as liquid crystals | Rolic AG (CH) | 1997-08-13 | — | — | EP | disclosed |