Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 3/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6451917 | 1.00 | KDM1A (0.39) | KDM1AMAOAMAOBDRD2ALDH1A1 | |
| SCHEMBL13417726 | 0.86 | DRD2 (0.44) | KDM1AMAOAMAOBDRD2ALDH1A1 | |
| SCHEMBL6451193 | 0.85 | KDM1A (0.39) | KDM1AMAOAMAOBDRD2ALDH1A1 | |
| SCHEMBL6451194 | 0.85 | KDM1A (0.39) | KDM1AMAOAMAOBDRD2ALDH1A1 | |
| SCHEMBL13615700 | 0.84 | DRD2 (0.47) | KDM1AMAOAMAOBDRD2ALDH1A1 | |
| SCHEMBL6464668 | 0.84 | KDM1A (0.38) | KDM1AMAOAMAOBDRD2ALDH1A1 | |
| SCHEMBL6464674 | 0.84 | KDM1A (0.38) | KDM1AMAOAMAOBDRD2ALDH1A1 | |
| SCHEMBL6464677 | 0.84 | KDM1A (0.38) | KDM1AMAOAMAOBDRD2ALDH1A1 | |
| SCHEMBL6451730 | 0.83 | SLC18A3 (0.35) | ALDH1A1SMN1; SMN2TP53HTR2C | |
| SCHEMBL6451733 | 0.83 | SLC18A3 (0.35) | ALDH1A1SMN1; SMN2TP53HTR2C |
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 |