Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 6/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6456288 | 1.00 | DGAT1 (0.33) | DGAT1SIGMAR1GRIN2BESR2PTGS1 | |
| SCHEMBL9254337 | 0.88 | ESR2 (0.41) | DGAT1ESR2ALDH1A1SMN1; SMN2CYP2C9 | |
| SCHEMBL9254345 | 0.88 | ESR2 (0.41) | DGAT1ESR2ALDH1A1SMN1; SMN2CYP2C9 | |
| SCHEMBL9254341 | 0.88 | ESR2 (0.41) | DGAT1ESR2ALDH1A1SMN1; SMN2CYP2C9 | |
| SCHEMBL6457695 | 0.87 | ESR2 (0.32) | ESR2PTGS1PTGS2CYP2C9SLC6A2 | |
| SCHEMBL6457691 | 0.87 | ESR2 (0.32) | ESR2PTGS1PTGS2CYP2C9SLC6A2 | |
| SCHEMBL6455952 | 0.86 | CYP2C9 (0.34) | DGAT1ESR2ALDH1A1CYP2C9HTR2C | |
| SCHEMBL6453104 | 0.86 | NPY5R (0.32) | — | |
| SCHEMBL6450760 | 0.86 | IDO1 (0.39) | DGAT1ESR2MAP1LC3BALDH1A1SMN1; SMN2 | |
| SCHEMBL6455957 | 0.86 | CYP2C9 (0.34) | DGAT1ESR2ALDH1A1CYP2C9HTR2C |
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 |
|---|---|---|---|---|---|---|---|
| US-6913797-B1 | Decahydronaphthalene derivative | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2005-07-05 | — | — | US | disclosed |
| EP-1108700-A1 | DECAHYDRONAPHTHALENE DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2001-06-20 | — | — | EP | disclosed |