Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL29136172 | 0.91 | CCR2 (0.38) | MAPTPTGS2IDO1TBXA2RCCR2 | |
| SCHEMBL29136176 | 0.87 | IDO1 (0.47) | THRBIDO1KMT2ACCR2MEN1 | |
| SCHEMBL29136187 | 0.84 | P2RX3 (0.39) | CCR2ALDH1A1 | |
| SCHEMBL29136185 | 0.81 | CCR2 (0.52) | MAPTPTGS2TBXA2RKMT2ACCR2 | |
| SCHEMBL29136197 | 0.80 | KDM4E (0.44) | MAPTPTGS2HTR3EHTR3BHTR1A | |
| SCHEMBL29136188 | 0.80 | RAB9A (0.42) | MAPTHTR3EHTR3BHTR1AHTR3A | |
| SCHEMBL29136200 | 0.78 | MAPT (0.46) | MAPTHTR1AKMT2ACCR2MEN1 | |
| SCHEMBL29136212 | 0.77 | DBH (0.42) | IDO1CCR2ALDH1A1SMN1; SMN2 | |
| SCHEMBL17187081 | 0.76 | HTR2A (0.37) | MAPTKMT2ACCR2ALDH1A1 | |
| SCHEMBL29136199 | 0.75 | CCR2 (0.55) | MAPTKMT2ACCR2MEN1ALDH1A1 |
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 |