Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | DGAT1 | O75907 | 5/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 3/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6460251 | 1.00 | CYP2C9 (0.33) | CYP2C9LMNAALDH1A1ESR2ESR1 | |
| SCHEMBL6458095 | 0.88 | CYP2C9 (0.43) | CYP2C9LMNAALDH1A1ESR2ESR1 | |
| SCHEMBL6458091 | 0.88 | CYP2C9 (0.43) | CYP2C9LMNAALDH1A1ESR2ESR1 | |
| SCHEMBL6458080 | 0.87 | FFAR1 (0.43) | CYP2C9LMNAESR2ESR1CYP3A4 | |
| SCHEMBL6458086 | 0.87 | FFAR1 (0.43) | CYP2C9LMNAESR2ESR1CYP3A4 | |
| SCHEMBL6453837 | 0.87 | SPHK1 (0.33) | CYP2C9LMNAALDH1A1ESR2ESR1 | |
| SCHEMBL6453835 | 0.87 | SPHK1 (0.33) | CYP2C9LMNAALDH1A1ESR2ESR1 | |
| SCHEMBL6459502 | 0.87 | SLC6A3 (0.36) | CYP2C9ALDH1A1ESR2ESR1CYP3A4 | |
| SCHEMBL6453157 | 0.87 | DRD2 (0.41) | DGAT1SOAT1SLC6A3KDM1A | |
| SCHEMBL6453160 | 0.87 | DRD2 (0.41) | DGAT1SOAT1SLC6A3KDM1A |
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 |