Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | TOP1 | P11387 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | ARG2 | P78540 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4254918 | 0.85 | MAOB (0.50) | ALDH1A1MAOBTOP1CA1CA2 | |
| SCHEMBL3359392 | 0.85 | MAOB (0.50) | ALDH1A1MAOBTOP1CA1CA2 | |
| SCHEMBL3359398 | 0.85 | MAOB (0.50) | ALDH1A1MAOBTOP1CA1CA2 | |
| Styrene SCHEMBL7747013 | 0.77 | ALDH1A1 (0.42) | ALDH1A1MAOBMAPTLMNARAB9A | |
| Allylbenzene SCHEMBL28273138 | 0.76 | ALDH1A1 (0.46) | ALDH1A1MAOBPTGS2SMN1; SMN2TSHR | |
| SCHEMBL28320915 | 0.76 | ELANE (0.41) | ALDH1A1MAPTLMNAELANEPKM | |
| SCHEMBL28249302 | 0.76 | KDM4E (0.33) | ALDH1A1MAPTLMNAPTGS2ELANE | |
| SCHEMBL13834343 | 0.74 | MAOB (0.44) | ALDH1A1MAOBTOP1CA1CA2 | |
| Allylbenzene SCHEMBL28861610 | 0.74 | ALDH1A1 (0.43) | ALDH1A1PTGS2SMN1; SMN2TSHRCYP3A4 | |
| SCHEMBL5045890 | 0.74 | ALDH1A1 (0.37) | ALDH1A1LMNATSHRHSD17B10 |
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-1995025090-A1 | CYCLIC N-ALKENYLOXYIMIDES AND A METHOD FOR THE PREPARATION OF CYCLIC N-ALKENYLOXYIMIDES, THE CORRESPONDING CYCLIC N-ALKOXYIMIDES AND O-ALKOXYAMINES | DSM N.V. (NL) | 1995-09-21 | — | — | WO | disclosed |