Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP13 | P45452 | 2/20 | 0.40 |
| ▸ | MMP14 | P50281 | 2/20 | 0.40 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21343732 | 0.91 | FAAH (0.35) | ALDH1A1HTTMMP2MMP13MMP14 | |
| SCHEMBL22992174 | 0.91 | HTT (0.41) | ALDH1A1HTTCYP2C9CYP2C19MAPK14 | |
| SCHEMBL21344670 | 0.89 | CHRM2 (0.42) | ALDH1A1HTTCYP2C9CYP2C19POLB | |
| SCHEMBL21344679 | 0.87 | NAMPT (0.42) | CYP2C9 | |
| SCHEMBL21344636 | 0.85 | L3MBTL1 (0.44) | ALDH1A1CYP2C9CYP2C19CYP3A4HPGD | |
| SCHEMBL21274089 | 0.84 | BTK (0.30) | — | |
| SCHEMBL21274392 | 0.84 | USP2 (0.35) | ALDH1A1CYP2C9CYP2C19CYP3A4HPGD | |
| SCHEMBL22992145 | 0.84 | GAA (0.33) | HTT | |
| SCHEMBL22992138 | 0.84 | CHRM2 (0.40) | ALDH1A1CYP2C9CYP2C19CYP3A4HPGD | |
| SCHEMBL22992155 | 0.84 | CYP3A4 (0.44) | ALDH1A1CYP2C9CYP2C19CYP3A4HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-3762378-B1 | HERBICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2022-05-18 | — | — | EP | disclosed |