Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL6450760 | 1.00 | IDO1 (0.39) | IDO1HTR3ADRD2DGAT1SOAT1 | |
| SCHEMBL6455002 | 0.87 | SLC6A3 (0.33) | IDO1HTR3ADRD2ESR2CYP2C9 | |
| SCHEMBL6454999 | 0.87 | SLC6A3 (0.33) | IDO1HTR3ADRD2ESR2CYP2C9 | |
| SCHEMBL6455952 | 0.86 | CYP2C9 (0.34) | DGAT1MAPK1ESR2MAPTCYP2C9 | |
| SCHEMBL6456282 | 0.86 | DGAT1 (0.33) | DGAT1ESR2CYP2C9MAP1LC3BALDH1A1 | |
| SCHEMBL6456288 | 0.86 | DGAT1 (0.33) | DGAT1ESR2CYP2C9MAP1LC3BALDH1A1 | |
| SCHEMBL6455957 | 0.86 | CYP2C9 (0.34) | DGAT1MAPK1ESR2MAPTCYP2C9 | |
| SCHEMBL6452410 | 0.85 | DRD2 (0.35) | IDO1HTR3ADRD2SLC2A1SRD5A1 | |
| SCHEMBL6452405 | 0.85 | DRD2 (0.35) | IDO1HTR3ADRD2SLC2A1SRD5A1 | |
| SCHEMBL6452401 | 0.85 | DRD2 (0.35) | IDO1HTR3ADRD2SLC2A1SRD5A1 |
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 |