Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | DRD4 | P21917 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL13724052 | 0.76 | HPGD (0.43) | DRD2DRD4DRD3WDR5L3MBTL1 | |
| SCHEMBL4461068 | 0.74 | DRD2 (0.40) | DRD2DRD4DRD3WDR5L3MBTL1 | |
| SCHEMBL9440408 | 0.72 | HPGD (0.54) | DRD2DRD4DRD3WDR5L3MBTL1 | |
| SCHEMBL13724692 | 0.72 | ACACB (0.46) | DRD2DRD4DRD3WDR5 | |
| SCHEMBL4455689 | 0.72 | KDM4E (0.38) | DRD2DRD4DRD3WDR5L3MBTL1 | |
| SCHEMBL11793991 | 0.70 | DRD2 (0.37) | DRD2DRD4DRD3WDR5L3MBTL1 | |
| SCHEMBL9778753 | 0.68 | DRD2 (0.42) | DRD2DRD4DRD3L3MBTL1KCNH2 | |
| SCHEMBL15299450 | 0.68 | WDR5 (0.46) | DRD2DRD4DRD3WDR5L3MBTL1 | |
| SCHEMBL15075279 | 0.67 | USP2 (0.41) | DRD2DRD4DRD3WDR5USP2 | |
| SCHEMBL12170820 | 0.67 | WDR5 (0.41) | DRD2DRD4DRD3WDR5L3MBTL1 |
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-107739365-A | A kind of preparation method of the base methanol of benzo [b] [1,4] oxygen thia hexamethylene 3 | 北京化工大学 | 2018-02-27 | — | — | CN | disclosed |