Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 3/20 | 0.36 |
| ▸ | PPARD | Q03181 | 2/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | BCR | P11274 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | VNN1 | O95497 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20203824 | 0.81 | CYP1A2 (0.67) | CYP1A2ADORA3ABL1PPARDGRIN2B | |
| SCHEMBL20203902 | 0.78 | CYP1A2 (0.71) | CYP1A2ADORA3ABL1PPARDGRIN2B | |
| SCHEMBL20203801 | 0.75 | CYP1A2 (0.67) | CYP1A2HDAC3HDAC1HDAC2ADORA3 | |
| SCHEMBL20189734 | 0.75 | CYP1A2 (0.61) | CYP1A2HDAC3HDAC1HDAC2ADORA3 | |
| SCHEMBL20204022 | 0.73 | CYP1A2 (0.69) | CYP1A2ADORA3ABL1GRIN2BSCN10A | |
| SCHEMBL20191119 | 0.72 | CYP1A2 (1.00) | CYP1A2ADORA3ABL1GRIN2BSCN10A | |
| SCHEMBL23571890 | 0.69 | CYP1A2 (0.69) | CYP1A2ADORA3ABL1GRIN2BSCN10A | |
| SCHEMBL26031183 | 0.69 | CYP1A2 (0.44) | CYP1A2DGAT1 | |
| SCHEMBL23571203 | 0.69 | CYP1A2 (0.57) | CYP1A2ADORA3ABL1SCN10ASCN2A | |
| SCHEMBL20190030 | 0.68 | CYP1A2 (0.63) | CYP1A2HDAC1HDAC2ADORA3ABL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018098499-A1 | COMPOUNDS AND THEIR METHODS OF USE | PRAXIS PRECISION MEDICINES, INC. (US) | 2018-05-31 | — | — | WO | disclosed |