Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6452826 | 0.85 | SLC6A3 (0.39) | SLC6A3SLC6A4PTPN11ALDH1A1KDM4E | |
| SCHEMBL6453506 | 0.84 | ALDH1A1 (0.35) | SLC6A3SLC6A4ALDH1A1KDM4EHPGD | |
| SCHEMBL6457380 | 0.84 | ALDH1A1 (0.38) | SLC6A3SLC6A4ALDH1A1KDM4EHPGD | |
| SCHEMBL6457384 | 0.84 | ALDH1A1 (0.38) | SLC6A3SLC6A4ALDH1A1KDM4EHPGD | |
| SCHEMBL7918483 | 0.84 | ALDH1A1 (0.35) | SLC6A3SLC6A4ALDH1A1KDM4EHPGD | |
| SCHEMBL264087 | 0.84 | PTPN11 (0.51) | SLC6A3SLC6A4PTPN11ALDH1A1KDM4E | |
| SCHEMBL6452460 | 0.83 | ALDH1A1 (0.46) | SLC6A3SLC6A4PTPN11ALDH1A1KDM4E | |
| SCHEMBL6459924 | 0.83 | ALDH1A1 (0.40) | SLC6A3SLC6A4ALDH1A1KDM4EHPGD | |
| SCHEMBL6459928 | 0.83 | ALDH1A1 (0.40) | SLC6A3SLC6A4ALDH1A1KDM4EHPGD | |
| SCHEMBL6454288 | 0.83 | PTPN11 (0.38) | SLC6A3SLC6A4PTPN11ALDH1A1KDM4E |
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 |