Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 8/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.33 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.32 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.32 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.32 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14972711 | 0.80 | SMPD1 (0.39) | SMPD1GABBR2GABRR1GABBR1S1PR2 | |
| SCHEMBL11298958 | 0.74 | TRPM8 (0.40) | TRPM8HPGDSMN1; SMN2SMPD1GABBR2 | |
| SCHEMBL777907 | 0.74 | TRPM8 (0.45) | TRPM8HPGDSMN1; SMN2SMPD1CYP3A4 | |
| SCHEMBL779432 | 0.72 | TRPM8 (0.48) | TRPM8HPGDSMN1; SMN2SMPD1CYP3A4 | |
| SCHEMBL15300961 | 0.72 | CYP3A4 (0.59) | CYP3A4 | |
| SCHEMBL9794954 | 0.71 | TRPM8 (0.42) | TRPM8HPGDSMN1; SMN2GABBR2GABRR1 | |
| SCHEMBL8417123 | 0.71 | GABBR2 (0.41) | TRPM8HPGDSMN1; SMN2SMPD1GABBR2 | |
| SCHEMBL16924864 | 0.71 | TRPM8 (0.38) | TRPM8FAAHHPGDSMN1; SMN2SMPD1 | |
| SCHEMBL16062699 | 0.70 | TRPM8 (0.52) | TRPM8FAAH | |
| SCHEMBL15301132 | 0.69 | CYP3A4 (0.55) | CYP3A4 |
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-2597717-A1 | Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same | Mitsubishi Chemical Corporation (JP) | 2013-05-29 | — | — | EP | disclosed |