Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.41 |
| ▸ | ANO2 | Q9NQ90 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29136200 | 0.80 | MAPT (0.46) | ALDH1A1KDM4EMAPTTP53L3MBTL1 | |
| SCHEMBL29136185 | 0.77 | CCR2 (0.52) | ALDH1A1KDM4EMAPTTP53KMT2A | |
| SCHEMBL29136199 | 0.77 | CCR2 (0.55) | ALDH1A1KDM4EMAPTTP53SMN1; SMN2 | |
| SCHEMBL29136212 | 0.76 | DBH (0.42) | ALDH1A1KDM4EIDO1SMN1; SMN2LMNA | |
| SCHEMBL6836318 | 0.75 | NPSR1 (0.47) | SLC6A2SLC6A4SLC6A3KCNH2ALDH1A1 | |
| SCHEMBL29136172 | 0.74 | CCR2 (0.38) | ALDH1A1KDM4EMAPTTP53IDO1 | |
| SCHEMBL17187081 | 0.73 | HTR2A (0.37) | SLC6A2ALDH1A1KDM4EMAPTTP53 | |
| SCHEMBL29136191 | 0.72 | MAPT (0.40) | KCNH2ALDH1A1MAPTIDO1SMN1; SMN2 | |
| SCHEMBL29136195 | 0.71 | SLC9A1 (0.48) | ALDH1A1MAPTIDO1SMN1; SMN2NPSR1 | |
| SCHEMBL29136176 | 0.69 | IDO1 (0.47) | ALDH1A1KDM4EIDO1L3MBTL1SMN1; SMN2 |
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-117003739-A | Nitrogen-containing heterocyclic compound, preparation method and application thereof | 安徽中医药大学 | 2023-11-07 | — | — | CN | disclosed |