Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 6/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19899811 | 0.81 | SIGMAR1 (0.50) | MAOATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5594577 | 0.79 | SIGMAR1 (0.48) | MAOATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL367519 | 0.79 | TRPA1 (0.48) | MAOATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3680285 | 0.78 | TAAR1 (0.57) | MAOATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL17802435 | 0.76 | SIGMAR1 (0.50) | MAOATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2477572 | 0.76 | SIGMAR1 (0.50) | MAOATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6387963 | 0.76 | SIGMAR1 (0.54) | MAOATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8675172 | 0.74 | SIGMAR1 (0.52) | MAOATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL97558 | 0.74 | TAAR1 (0.52) | MAOATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2748352 | 0.74 | MAOB (0.56) | MAOATAAR1SLC6A2SLC6A4SLC6A3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111548299-A | Preparation method of N-methyl-3-benzylmercapto-4-amino maleimide compound | 温州医科大学 | 2020-08-18 | — | — | CN | claimed |
| CN-111393350-A | Synthesis method of N-methyl-3-substituted benzylmercapto-4-morpholinyl maleimide compound | 温州医科大学 | 2020-07-10 | — | — | CN | claimed |
| CN-111440108-A | Synthetic method of N-substituted-3-benzylmercapto-4-morpholinyl maleimide compound | 温州医科大学 | 2020-07-24 | — | — | CN | disclosed |
| CN-111440108-A | Synthetic method of N-substituted-3-benzylmercapto-4-morpholinyl maleimide compound | 温州医科大学 | 2020-07-24 | — | — | CN | disclosed |
| CN-111393350-A | Synthesis method of N-methyl-3-substituted benzylmercapto-4-morpholinyl maleimide compound | 温州医科大学 | 2020-07-10 | — | — | CN | disclosed |