Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | TYR | P14679 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | USP5 | P45974 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL254340 | 0.94 | CYP2A6 (0.50) | CYP1A2SMN1; SMN2ALOX5TYRPOLB | |
| SCHEMBL3970246 | 0.92 | CYP2A6 (0.47) | CYP1A2SMN1; SMN2ALOX5TYRPOLB | |
| Magnesium SCHEMBL31125581 | 0.92 | CYP2A6 (0.47) | CYP1A2SMN1; SMN2ALOX5TYRPOLB | |
| SCHEMBL13291828 | 0.86 | ALDH1A1 (0.48) | CYP1A2SMN1; SMN2ALOX5TYRPOLB | |
| Hydrogen Peroxide SCHEMBL20915049 | 0.85 | TYR (0.55) | SMN1; SMN2CYP2C9CYP2D6HIF1ATYR | |
| Hydrogen Peroxide SCHEMBL182135 | 0.85 | TYR (0.55) | SMN1; SMN2CYP2C9CYP2D6HIF1ATYR | |
| Hydrogen Peroxide SCHEMBL461155 | 0.85 | TYR (0.55) | SMN1; SMN2CYP2C9CYP2D6HIF1ATYR | |
| SCHEMBL22781054 | 0.82 | NPC1 (0.42) | CYP1A2ALOX5TYRPOLBHTT | |
| Hydrogen Peroxide SCHEMBL20534035 | 0.82 | TYR (0.52) | SMN1; SMN2CYP2C9CYP2D6HIF1ATYR | |
| SCHEMBL2684030 | 0.82 | LMNA (0.55) | CYP1A2SMN1; SMN2ALOX5CYP2C9POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113651308-A | Azalea leaf derived carbon material and preparation method and application thereof | 浙江工业大学 | 2021-11-16 | — | — | CN | disclosed |
| CN-113600191-A | Copper (II) doped chitosan carbon material and preparation method and application thereof | 浙江工业大学 | 2021-11-05 | — | — | CN | disclosed |
| CN-111675599-A | Method for catalyzing and oxidizing aromatic benzyl tertiary C-H bond into tertiary alcohol by metalloporphyrin | 浙江工业大学 | 2020-09-18 | — | — | CN | disclosed |