Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL9809156 | 0.92 | SLC6A4 (0.47) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL31546073 | 0.78 | SLC6A4 (0.46) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL10517137 | 0.78 | SLC6A3 (0.50) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL9451018 | 0.76 | MEN1 (0.41) | LMNA | |
| SCHEMBL733501 | 0.74 | CYP2C19 (0.58) | SLC6A2SLC6A3HTR2B | |
| SCHEMBL9911677 | 0.74 | KDM4E (0.35) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL5852687 | 0.74 | TSHR (0.54) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL10300821 | 0.74 | TSHR (0.54) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL29434698 | 0.74 | TSHR (0.54) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL1119954 | 0.74 | TSHR (0.54) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2007031373-A | 2-NAPHTHYL-1,3-DIOXANE DERIVATIVE | DAINIPPON INK & CHEM INC | 2007-02-08 | — | — | JP | disclosed |
| JP-2006036719-A | 2-NAPHTHYL-1,3-DIOXANE DERIVATIVE | DAINIPPON INK & CHEM INC | 2006-02-09 | — | — | JP | disclosed |