Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 4/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 2/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25962200 | 0.90 | SLC6A3 (0.35) | SLC6A3HSD11B1PDK2PTGDR2 | |
| SCHEMBL23318634 | 0.87 | HSD11B1 (0.38) | HSD11B1PDK2CHRM1ALDH1A1 | |
| SCHEMBL23318635 | 0.87 | SLC6A3 (0.38) | SLC6A3HSD11B1PDK2ALDH1A1ADORA3 | |
| SCHEMBL23609590 | 0.86 | TDP2 (0.39) | HSD11B1PDK2 | |
| SCHEMBL23318795 | 0.86 | SLC6A3 (0.37) | SLC6A3HSD11B1PDK2ALDH1A1PTGS2 | |
| SCHEMBL30593282 | 0.86 | PDK2 (0.40) | SLC6A3HSD11B1PDK2NPSR1 | |
| SCHEMBL25582581 | 0.86 | PDK2 (0.40) | SLC6A3HSD11B1PDK2NPSR1 | |
| SCHEMBL23318889 | 0.85 | PDK2 (0.39) | HSD11B1PDK2CHRM1 | |
| SCHEMBL24618091 | 0.84 | HSD11B1 (0.36) | HSD11B1PDK2 | |
| SCHEMBL23609300 | 0.84 | PDK2 (0.35) | SLC6A3HSD11B1PDK2AKR1A1AKR1B1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023142492-A1 | ORGANIC COMPOUND, ELECTRONIC COMPONENT, AND ELECTRONIC DEVICE | 陕西莱特光电材料股份有限公司 | 2023-08-03 | — | — | WO | disclosed |