Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | CFTR | P13569 | 1/20 | 0.52 |
| ▸ | CTSD | P07339 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.51 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7174241 | 1.00 | SLC6A3 (0.60) | SLC6A3SLC6A4TSHRMAPTHSD17B10 | |
| Methyl 2-Methoxybenzoate SCHEMBL196037 | 0.88 | TSHR (0.69) | SLC6A3SLC6A4TSHRMAPTHSD17B10 | |
| Methyl 2-Methoxybenzoate SCHEMBL29702077 | 0.88 | TSHR (0.69) | SLC6A3SLC6A4TSHRMAPTHSD17B10 | |
| SCHEMBL69464 | 0.88 | SLC6A3 (0.67) | SLC6A3SLC6A4TSHRMAPTHSD17B10 | |
| Methyl 2-Methoxybenzoate SCHEMBL30744939 | 0.86 | MAPT (0.67) | SLC6A3SLC6A4TSHRMAPTHSD17B10 | |
| SCHEMBL30285122 | 0.86 | SLC6A3 (0.61) | SLC6A3SLC6A4TSHRMAPTHSD17B10 | |
| SCHEMBL1638896 | 0.86 | SLC6A3 (0.58) | SLC6A3SLC6A4TSHRMAPTHSD17B10 | |
| Methyl 2-Methoxybenzoate SCHEMBL5182927 | 0.85 | SLC6A3 (0.66) | SLC6A3SLC6A4TSHRMAPTHSD17B10 | |
| SCHEMBL7481393 | 0.84 | TSHR (0.63) | SLC6A3SLC6A4TSHRMAPTHSD17B10 | |
| SCHEMBL1638900 | 0.84 | SLC6A3 (0.61) | SLC6A3SLC6A4TSHRMAPTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109311813-B | Palladium-catalyzed meta-C-H functionalized universal ligands | 斯克利普斯研究院 | 2023-02-28 | — | — | CN | disclosed |