Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5049371 | 0.76 | CNR1 (0.49) | HSD11B1 | |
| SCHEMBL5051904 | 0.73 | GAA (0.42) | GAAKDM4ELMNAL3MBTL1CYP1A2 | |
| SCHEMBL31005178 | 0.68 | HTT (0.54) | TSHRMAPK1SMN1; SMN2GAAKDM4E | |
| SCHEMBL13307797 | 0.67 | CNR1 (0.70) | TSHRSMN1; SMN2GAAKDM4ELMNA | |
| SCHEMBL5053646 | 0.66 | MEN1 (0.55) | SMN1; SMN2GAAKDM4ELMNAL3MBTL1 | |
| SCHEMBL3781020 | 0.65 | SMN1; SMN2 (0.50) | TSHRMAPK1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL1232285 | 0.65 | SMN1; SMN2 (0.50) | TSHRMAPK1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL12314560 | 0.65 | SMN1; SMN2 (0.50) | TSHRMAPK1SMN1; SMN2KDM4ECYP1A2 | |
| SCHEMBL24422087 | 0.64 | CYP1A2 (0.43) | SMN1; SMN2GAALMNAL3MBTL1CYP1A2 | |
| SCHEMBL26360990 | 0.64 | CYP1A2 (0.43) | SMN1; SMN2GAALMNAL3MBTL1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1921072-A1 | 1,2,3-Triazole derivatives as cannabinoid-receptor modulators | Laboratorios del Dr. Esteve S.A. (ES) | 2008-05-14 | — | — | EP | claimed |
| EP-1921072-A1 | 1,2,3-Triazole derivatives as cannabinoid-receptor modulators | Laboratorios del Dr. Esteve S.A. (ES) | 2008-05-14 | — | — | EP | disclosed |