Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 2/20 | 0.35 |
| ▸ | HTR1B | P28222 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | PLK1 | P53350 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
| ▸ | TYK2 | P29597 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 1/20 | 0.30 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.30 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22945901 | 0.79 | MEN1 (0.38) | KMT2A | |
| SCHEMBL22945899 | 0.79 | KMT2A (0.37) | CYP1A2CYP2C19KMT2AKDM4EJAK2 | |
| SCHEMBL22945854 | 0.75 | ALDH1A1 (0.34) | CYP1A2CYP2C19USP2HTR1A | |
| SCHEMBL22946170 | 0.75 | ALDH1A1 (0.40) | KMT2A | |
| SCHEMBL22945894 | 0.72 | ABCB1 (0.38) | CYP1A2CYP2C19KMT2AKDM4E | |
| SCHEMBL22945890 | 0.69 | HSD11B1 (0.31) | CYP1A2CYP2C19KMT2AUSP2 | |
| SCHEMBL22945861 | 0.69 | MAPT (0.35) | CYP1A2CYP2C19KMT2A | |
| SCHEMBL22945898 | 0.68 | KMT2A (0.38) | CYP1A2CYP2C19KMT2AKDM4EJAK2 | |
| SCHEMBL22946164 | 0.67 | CYP2A13 (0.35) | GAAKDM4E | |
| SCHEMBL10961245 | 0.67 | ALKBH1 (0.41) | CYP2C19 |
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-2021018135-A1 | HETEROCYCLYL ALKYL SUBSTITUTED DICHLOROBENZOYL COMPOUNDS AND APPLICATIONS THEREOF | 东莞市东阳光农药研发有限公司 | 2021-02-04 | — | — | WO | disclosed |