Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL11915998 | 0.86 | EP300 (0.41) | DRD2DRD4DRD3HRH1 | |
| SCHEMBL28958743 | 0.80 | PDE10A (0.45) | KMT2ALMNADRD2DRD4DRD3 | |
| SCHEMBL28965124 | 0.77 | DRD2 (0.44) | KMT2ALMNADRD2DRD4DRD3 | |
| SCHEMBL15104529 | 0.73 | DRD2 (0.43) | DRD2DRD4DRD3HRH3PABPC1 | |
| SCHEMBL8808928 | 0.70 | GFER (0.56) | CYP2D6CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL28958741 | 0.70 | DRD2 (0.52) | KMT2ALMNADRD2DRD4DRD3 | |
| SCHEMBL11916009 | 0.69 | CYP2D6 (0.51) | CYP2D6CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL9891489 | 0.68 | TMIGD3 (0.42) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL11926965 | 0.68 | HRH1 (0.45) | HRH1GAA | |
| SCHEMBL2736187 | 0.68 | DRD2 (0.44) | KMT2ADRD2DRD4DRD3HRH1 |
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-113264901-B | Amino phenol oxygroup zinc complex containing 2-substituted thiazole-4-group and preparation method and application thereof | 华东理工大学 | 2023-02-28 | — | — | CN | disclosed |
| CN-113264901-A | Amino phenol oxygroup zinc complex containing 2-substituted thiazole-4-group and preparation method and application thereof | 华东理工大学 | 2021-08-17 | — | — | CN | disclosed |