Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 6/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | HNF4A | P41235 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2825364 | 0.90 | SLC6A9 (0.51) | SLC6A9KCNH2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL27100481 | 0.88 | SLC6A9 (0.49) | SLC6A9KCNH2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL1814036 | 0.80 | LMNA (0.48) | SLC6A9KCNH2CYP2C9PTGDR2CYP2D6 | |
| SCHEMBL3882695 | 0.78 | LMNA (0.46) | SLC6A9KCNH2ALDH1A1CYP2C9KDM4E | |
| SCHEMBL4422116 | 0.78 | EPAS1 (0.43) | SLC6A9KCNH2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL7694742 | 0.77 | KDM4E (0.73) | ALDH1A1CYP1A2CYP2C9KDM4EMEN1 | |
| SCHEMBL28064700 | 0.77 | PTGS2 (0.44) | SLC6A9KCNH2ALDH1A1MEN1HPGD | |
| SCHEMBL2825627 | 0.77 | LMNA (0.51) | SLC6A9KCNH2CYP2C9PTGDR2CYP2D6 | |
| SCHEMBL3873094 | 0.77 | SLC6A9 (0.56) | SLC6A9KCNH2PTGDR2PTGS2 | |
| SCHEMBL5183828 | 0.77 | LMNA (0.48) | SLC6A9KCNH2CYP2C9PTGDR2CYP2D6 |
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-105712945-A | 2-Substituted-oxy-5-methylsulfonyl aryl piperazine acidamide analogue and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2016-06-29 | — | — | CN | disclosed |