Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 6/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.39 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15946485 | 0.83 | CYP1A2 (0.39) | SLC6A2SLC6A4SLC6A3CYP1A2ESR1 | |
| SCHEMBL9654195 | 0.81 | CYP1A2 (0.41) | SLC6A4CYP1A2 | |
| SCHEMBL28118214 | 0.81 | GRIN2D (0.39) | CYP1A2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL13871447 | 0.80 | CYP1A2 (0.46) | SLC6A2SLC6A4SLC6A3CYP1A2ESR1 | |
| SCHEMBL28769600 | 0.79 | ERN1 (0.42) | SLC6A2SLC6A4CYP1A2POLB | |
| SCHEMBL7037863 | 0.79 | BCHE (0.32) | — | |
| SCHEMBL7858267 | 0.79 | PLAU (0.49) | — | |
| SCHEMBL2946 | 0.77 | ALDH1A1 (0.47) | SLC6A4 | |
| SCHEMBL27301541 | 0.77 | CYP1A2 (0.47) | CYP1A2MAOAIDH1 | |
| SCHEMBL10745584 | 0.77 | CYP1A2 (0.43) | SLC6A2SLC6A4SLC6A3CYP1A2ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101468943-B | Preparation technique of 1,6-dimethoxynaphthalene | NANTONG BAISHENG CHEMICAL INDUSTRY CO LTD | 2011-08-31 | — | — | CN | disclosed |
| CN-101468943-A | Preparation technique of 1,6-dimethoxynaphthalene | NANTONG LAIJIALI CHEMICAL CO L (CN) | 2009-07-01 | — | — | CN | disclosed |