Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 4/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14865093 | 0.86 | ALOX5 (0.50) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL20835869 | 0.85 | ALOX5 (0.52) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL13470911 | 0.85 | ALOX5 (0.52) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL17511100 | 0.85 | ALOX5 (0.52) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL17511101 | 0.85 | ALOX5 (0.52) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL30364885 | 0.84 | ALOX5 (0.51) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL16210517 | 0.80 | ALOX5 (0.53) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL19320482 | 0.80 | ALOX5 (0.53) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL2775430 | 0.80 | HTT (0.58) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL16210516 | 0.80 | ALOX5 (0.53) | ALOX5PTGS2SMN1; SMN2ALDH1A1KDM4E |
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-2015135984-A1 | METHOD FOR PRODUCING CHIRAL 3-(5-AMINOTRIAZOLYL)-SULPHOXIDE DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2015-09-17 | — | — | WO | disclosed |