Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLD1 | Q13393 | 10/20 | 0.62 |
| ▸ | PLD2 | O14939 | 9/20 | 0.62 |
| ▸ | DRD2 | P14416 | 5/20 | 0.62 |
| ▸ | DRD3 | P35462 | 5/20 | 0.62 |
| ▸ | HTR1A | P08908 | 3/20 | 0.62 |
| ▸ | HTR2A | P28223 | 3/20 | 0.62 |
| ▸ | HTR2C | P28335 | 3/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | POLR1A | O95602 | 1/20 | 0.56 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.55 |
| ▸ | STAMBP | O95630 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL28070988 | 0.88 | HDAC3 (0.55) | PLD1PLD2DRD2DRD3HTR1A | |
| SCHEMBL30858823 | 0.79 | HDAC3 (0.61) | PLD1PLD2DRD2DRD3HTR1A | |
| SCHEMBL2639342 | 0.79 | PPARD (0.57) | PLD1PLD2DRD2DRD3HTR1A | |
| SCHEMBL2639346 | 0.79 | MGAM (0.56) | PLD1PLD2DRD2DRD3HTR1A | |
| SCHEMBL29222038 | 0.79 | HDAC3 (0.61) | PLD1PLD2DRD2DRD3HTR1A | |
| SCHEMBL1311320 | 0.79 | CHRNB2 (0.60) | PLD1PLD2DRD2DRD3HTR1A | |
| SCHEMBL4533987 | 0.78 | SLC6A4 (0.72) | DRD2DRD3HTR1AHTR2AHTR2C | |
| SCHEMBL1312027 | 0.78 | CHRNB2 (0.61) | DRD2DRD3HTR1AHTR2AHTR2C | |
| SCHEMBL2724179 | 0.78 | PLD2 (0.88) | PLD1PLD2 | |
| SCHEMBL10311349 | 0.78 | PLD2 (1.00) | PLD1PLD2 |
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-105814040-A | Fused 1,4-dihydrodioxin derivatives as inhibitors of heat shock transcription factor 1 | 癌症研究科技有限公司 | 2016-07-27 | — | — | CN | disclosed |