Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | MDM4 | O15151 | 1/20 | 0.56 |
| ▸ | MITF | O75030 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | GSK3A | P49840 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 4/20 | 0.48 |
| ▸ | ALB | P02768 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4730004 | 0.87 | TDP1 (0.74) | TDP1ALDH1A1MDM4MITFHTT | |
| SCHEMBL458748 | 0.84 | TDP1 (0.73) | TDP1ALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL30385229 | 0.84 | TDP1 (0.73) | TDP1ALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL8074225 | 0.81 | TDP1 (0.85) | TDP1ALDH1A1HTTATMSMN1; SMN2 | |
| SCHEMBL15549560 | 0.80 | TDP1 (0.57) | TDP1ALDH1A1MDM4MITFHTT | |
| SCHEMBL27866324 | 0.80 | TDP1 (0.57) | TDP1ALDH1A1MDM4MITFHTT | |
| SCHEMBL15843974 | 0.79 | TDP1 (0.60) | TDP1ALDH1A1MDM4MITFHTT | |
| SCHEMBL4733403 | 0.78 | TDP1 (0.74) | TDP1ALDH1A1MDM4MITFHTT | |
| SCHEMBL15548299 | 0.77 | TDP1 (0.54) | TDP1ALDH1A1MDM4MITFHTT | |
| SCHEMBL8470725 | 0.76 | TDP1 (0.59) | TDP1ALDH1A1HTTSMN1; SMN2GAA |
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-104292156-A | Boscalid homologs and uncoupling synthesis method thereof as well as application of boscalid homologs in preparing medicines for preventing and treating pathogenic bacteria | JIANGSU FREY AGROCHEMICALS CO LTD | 2015-01-21 | — | — | CN | disclosed |