Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MARS1 | P56192 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28760197 | 0.96 | CYP1A2 (0.49) | CYP1A2CYP2C9CYP3A4CYP2C19MARS1 | |
| SCHEMBL27677824 | 0.96 | MARS1 (0.46) | CYP1A2CYP2C9CYP3A4CYP2C19MARS1 | |
| SCHEMBL28024007 | 0.91 | MAPT (0.48) | CYP1A2CYP2C9CYP3A4CYP2C19MARS1 | |
| SCHEMBL27687135 | 0.74 | MARS1 (0.65) | CYP1A2CYP2C9MARS1KMT2AMEN1 | |
| SCHEMBL7901219 | 0.71 | MAPT (0.59) | MARS1SMN1; SMN2MAPT | |
| SCHEMBL27706388 | 0.71 | GRN (0.56) | CYP1A2CYP2C9MARS1KMT2AMEN1 | |
| SCHEMBL27687138 | 0.70 | SMN1; SMN2 (0.69) | CYP1A2CYP2C9MARS1KMT2AMEN1 | |
| SCHEMBL8889722 | 0.70 | MAPT (0.70) | CYP1A2CYP2C9MARS1KMT2AMEN1 | |
| SCHEMBL6938286 | 0.69 | CYP1A2 (0.63) | CYP1A2KMT2AMEN1LMNAHTT | |
| SCHEMBL17593153 | 0.69 | SMN1; SMN2 (0.56) | MARS1HTTSMN1; SMN2MAPTCA12 |
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-1958589-A | 6 (aryloxy methyl) - 2 aryl - 6, 7 dihydro 4H - pyrido [5,1 c ] [1,4] oxaxine - 4 - ketone derivative, and preparation method | UNIV SHANDONG (CN) | 2007-05-09 | — | — | CN | disclosed |