Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 4/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6472818 | 0.82 | AHR (0.59) | AHRPTGS2PTGS1SLC6A3SLC6A2 | |
| SCHEMBL4808905 | 0.77 | AHR (0.56) | AHRPTGS2PTGS1SLC6A3SLC6A2 | |
| SCHEMBL9870874 | 0.74 | AHR (0.65) | AHRPTGS2PTGS1SLC6A3SLC6A2 | |
| SCHEMBL3526596 | 0.71 | MAPT (0.46) | AHRPTGS2PTGS1SLC6A3SLC6A2 | |
| SCHEMBL8350674 | 0.68 | AHR (0.45) | AHRSLC6A3SLC6A2MAPTHTT | |
| SCHEMBL27872944 | 0.67 | NOTUM (0.40) | PTGS2PTGS1MAPTHTTALDH1A1 | |
| SCHEMBL29769221 | 0.66 | AHR (1.00) | AHRMAPTHTTALDH1A1KDM4E | |
| SCHEMBL137915 | 0.66 | AHR (1.00) | AHRMAPTHTTALDH1A1KDM4E | |
| SCHEMBL15516726 | 0.66 | PTGS2 (0.51) | PTGS2PTGS1SLC6A3SLC6A4 | |
| SCHEMBL15516729 | 0.66 | PTGS2 (0.41) | AHRPTGS2PTGS1SLC6A3SLC6A2 |
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-101394847-B | Cycloalkylamines as monoamine reuptake inhibitors | 塞普拉柯公司 | 2017-05-24 | — | — | CN | disclosed |