Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.59 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | ACHE | P22303 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | BLM | P54132 | 2/20 | 0.57 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | SCN1A | P35498 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL876075 | 0.91 | ALDH1A1 (0.54) | ALDH1A1LMNASLC22A2SLC22A1TSHR | |
| SCHEMBL875973 | 0.91 | ALDH1A1 (0.54) | ALDH1A1LMNASLC22A2SLC22A1TSHR | |
| SCHEMBL9490255 | 0.85 | ALDH1A1 (0.70) | ALDH1A1LMNASLC22A2SLC22A1TSHR | |
| SCHEMBL883389 | 0.80 | ALDH1A1 (0.52) | ALDH1A1LMNASLC22A2SLC22A1TSHR | |
| SCHEMBL23663764 | 0.78 | ALDH1A1 (0.73) | ALDH1A1LMNASLC22A2SLC22A1TSHR | |
| SCHEMBL875505 | 0.78 | DNMT1 (0.64) | ALDH1A1LMNASLC22A2SLC22A1TSHR | |
| SCHEMBL26752805 | 0.77 | ALDH1A1 (0.74) | ALDH1A1LMNASLC22A2SLC22A1TSHR | |
| SCHEMBL19123079 | 0.77 | ALDH1A1 (0.62) | ALDH1A1LMNASLC22A2SLC22A1TSHR | |
| SCHEMBL3377144 | 0.76 | ALDH1A1 (0.74) | ALDH1A1LMNASLC22A2SLC22A1TSHR | |
| SCHEMBL5925645 | 0.76 | ALDH1A1 (0.74) | ALDH1A1LMNASLC22A2SLC22A1TSHR |
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-2012038417-A1 | SUBSTITUTED AMINO - BENZOIC ACID DERIVATIVES AS INHIBITORS OF DNA METHYLTRANSFERASES | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2012-03-29 | — | — | WO | disclosed |