Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.36 |
| ▸ | DBH | P09172 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29136224 | 0.86 | IDO1 (0.46) | THRBGAAIDO1SMN1; SMN2LMNA | |
| SCHEMBL29136189 | 0.81 | MAPT (0.47) | MAPTSMN1; SMN2LMNAKMT2ATBXA2R | |
| SCHEMBL2117187 | 0.80 | CD74 (0.40) | MAPTGAASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL3849945 | 0.80 | ALDH1A1 (0.46) | MAPTTHRBSMN1; SMN2LMNAKMT2A | |
| SCHEMBL4377626 | 0.79 | CACNB4 (0.45) | MAPTKCNH2SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL6204780 | 0.78 | MAOB (0.43) | THRB | |
| SCHEMBL29136178 | 0.77 | DBH (0.46) | IDO1SMN1; SMN2LMNADBHKMT2A | |
| SCHEMBL4384076 | 0.75 | KCNA3 (0.46) | MAPTSMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL27905750 | 0.74 | HTT (0.49) | MAPTIDO1SMN1; SMN2LMNAKMT2A | |
| SCHEMBL27731280 | 0.74 | SERPINE1 (0.44) | IDO1ALDH1A1 |
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 |