Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19612394 | 1.00 | CYP2C9 (0.46) | CYP2C9CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL30003061 | 0.94 | S1PR5 (0.47) | CYP2C9CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL23271817 | 0.94 | S1PR5 (0.47) | CYP2C9CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL23271786 | 0.94 | S1PR5 (0.47) | CYP2C9CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL19612246 | 0.94 | S1PR5 (0.47) | CYP2C9CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL23271981 | 0.92 | HTT (0.45) | MAPTKDM4EALDH1A1LMNANPSR1 | |
| SCHEMBL29025217 | 0.86 | CYP2C9 (0.49) | CYP2C9CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL23271964 | 0.83 | HTT (0.44) | MAPTKDM4EALDH1A1LMNAHTT | |
| SCHEMBL23271793 | 0.83 | IDO1 (0.51) | MAPTKDM4EALDH1A1LMNAHTT | |
| SCHEMBL30003499 | 0.83 | HTT (0.44) | MAPTKDM4EALDH1A1LMNAHTT |
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-110891980-B | Radical polymerization control agent and radical polymerization control method | 川崎化成工业株式会社 | 2022-09-30 | — | — | CN | disclosed |