Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 2/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14294140 | 0.84 | ELANE (0.34) | ELANECES2CES1AKT1MEN1 | |
| SCHEMBL21697627 | 0.80 | CES2 (0.39) | ELANECES2CES1AKT1MEN1 | |
| SCHEMBL658242 | 0.79 | CES1 (0.41) | CES2CES1AKT1MEN1KMT2A | |
| SCHEMBL10653399 | 0.77 | CES2 (0.46) | ELANECES2CES1AKT1MEN1 | |
| SCHEMBL18570813 | 0.72 | CES2 (0.37) | ELANECES2CES1AKT1MEN1 | |
| SCHEMBL14629141 | 0.72 | MAPT (0.42) | MEN1KMT2AMAPTLMNASMN1; SMN2 | |
| SCHEMBL285026 | 0.71 | CA2 (0.48) | CES2CES1AKT1MEN1KMT2A | |
| SCHEMBL19677236 | 0.71 | CES2 (0.35) | ELANECES2CES1AKT1MEN1 | |
| SCHEMBL22644676 | 0.71 | CA1 (0.41) | MEN1KMT2ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL7087951 | 0.70 | KMT2A (0.45) | CES2CES1AKT1MEN1KMT2A |
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-2390249-B1 | NOVEL CYCLOALKENE DERIVATIVES AND ORGANIC ELECTRONIC DEVICES USING THE SAME | LG CHEMICAL LTD (KR) | 2015-08-26 | — | — | EP | disclosed |