Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 4/20 | 0.40 |
| ▸ | NOS2 | P35228 | 4/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | ANPEP | P15144 | 1/20 | 0.40 |
| ▸ | LAP3 | P28838 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27826220 | 0.86 | SRC (0.53) | LOXL2MAOBENPP2TAAR1ANPEP | |
| SCHEMBL28031670 | 0.82 | CYP2C19 (0.68) | SMN1; SMN2CYP2C19LOXL2MAOBANPEP | |
| SCHEMBL505384 | 0.82 | CYP2C19 (0.50) | SMN1; SMN2CYP2C19LMNAMAPTHTT | |
| SCHEMBL27375052 | 0.79 | ENPP2 (0.46) | SMN1; SMN2LOXL2MAOBENPP2TAAR1 | |
| SCHEMBL27899253 | 0.78 | MEN1 (0.45) | LOXL2MAOBTAAR1ACHE | |
| Phosphoric Acid SCHEMBL29157454 | 0.76 | ENPP2 (0.58) | SMN1; SMN2CYP2C19LOXL2ENPP2NOS1 | |
| SCHEMBL2910659 | 0.75 | CYP3A4 (0.52) | SMN1; SMN2CYP2C19ACHELMNAALDH1A1 | |
| SCHEMBL28074475 | 0.75 | HCRTR1 (0.54) | SMN1; SMN2CYP2C19ENPP2ACHELMNA | |
| Benzylamine SCHEMBL5685880 | 0.74 | LOXL2 (0.64) | CYP2C19LOXL2ENPP2TAAR1ANPEP | |
| Phosphoric Acid SCHEMBL29157451 | 0.74 | ENPP2 (0.56) | SMN1; SMN2CYP2C19LOXL2ENPP2NOS1 |
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-104744510-B | Alizarin aminophosphonate ester derivatives and synthetic method thereof and application | 广西师范大学 | 2016-08-17 | — | — | CN | claimed |
| CN-104744510-B | Alizarin aminophosphonate ester derivatives and synthetic method thereof and application | 广西师范大学 | 2016-08-17 | — | — | CN | disclosed |