Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 3/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 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 | |
|---|---|---|---|---|
| SCHEMBL6460617 | 1.00 | KDM1A (0.46) | KDM1AALDH1A1MAPTHTTCYP2C9 | |
| SCHEMBL6458956 | 0.94 | KDM1A (0.47) | KDM1AALDH1A1MAPTHTTCYP2C9 | |
| SCHEMBL6458961 | 0.94 | KDM1A (0.47) | KDM1AALDH1A1MAPTHTTCYP2C9 | |
| SCHEMBL6460322 | 0.90 | KDM1A (0.36) | KDM1AALDH1A1MAPTCYP2C9LMNA | |
| SCHEMBL6460328 | 0.90 | KDM1A (0.36) | KDM1AALDH1A1MAPTCYP2C9LMNA | |
| SCHEMBL6458552 | 0.89 | KDM1A (0.35) | KDM1AALDH1A1MAPTHTTCYP2C9 | |
| SCHEMBL6458556 | 0.89 | KDM1A (0.35) | KDM1AALDH1A1MAPTHTTCYP2C9 | |
| SCHEMBL6454099 | 0.87 | CYP2C9 (0.41) | KDM1AALDH1A1MAPTCYP2C9LMNA | |
| SCHEMBL14525709 | 0.87 | CYP2C9 (0.41) | KDM1AALDH1A1MAPTCYP2C9LMNA | |
| SCHEMBL6454102 | 0.87 | CYP2C9 (0.41) | KDM1AALDH1A1MAPTCYP2C9LMNA |
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 |