Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | PRNP | P04156 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12258284 | 0.77 | CASP1 (0.43) | KMT2AMEN1SLC2A1HPRT1MAPT | |
| SCHEMBL18799865 | 0.76 | SLC2A1 (0.41) | SLC2A1HPRT1MAPTCASP1CASP7 | |
| SCHEMBL465585 | 0.75 | ALDH1A1 (0.46) | POLBMAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29561158 | 0.75 | ALDH1A1 (0.46) | POLBMAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL31582651 | 0.75 | LMNA (0.35) | KMT2AMEN1MAPTGAACASP1 | |
| SCHEMBL8154303 | 0.74 | FDPS (0.47) | KMT2AMEN1POLBMAPTKDM4E | |
| SCHEMBL8156586 | 0.73 | FDPS (0.39) | KMT2AMEN1POLBSLC2A1MAPT | |
| SCHEMBL10644280 | 0.69 | PDE10A (0.48) | KMT2AMEN1POLBPTPN1SLC2A1 | |
| SCHEMBL10063578 | 0.68 | KDM5A (0.41) | KMT2AMEN1ERN1CYP1A2CYP2C9 | |
| SCHEMBL29935946 | 0.68 | KDM5A (0.41) | KMT2AMEN1ERN1CYP1A2CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109912576-B | Cyclic or spirocyclic diamine pyrimidine-hydroxamic acids and their use | 华东理工大学 | 2021-11-19 | — | — | CN | disclosed |
| CN-109810108-B | 2, 8-diaza-spiro- [4,5] -decane pyrimidine-hydroxamic acid compound and application thereof | 华东理工大学 | 2021-08-06 | — | — | CN | disclosed |