Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 16/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27988286 | 0.77 | MET (0.42) | METKDM4EALDH1A1TP53HSP90AA1 | |
| SCHEMBL2575351 | 0.77 | MET (0.51) | METKDM4EALDH1A1TP53HSP90AA1 | |
| SCHEMBL1329537 | 0.75 | CASP6 (0.45) | METCASP6KDM4EALDH1A1TP53 | |
| SCHEMBL28864698 | 0.74 | NPC1 (0.35) | METKDM4EALDH1A1HTTNPC1 | |
| SCHEMBL1161458 | 0.74 | ALDH1A1 (0.46) | METCASP6KDM4EALDH1A1TP53 | |
| SCHEMBL30174396 | 0.74 | ALDH1A1 (0.46) | METCASP6KDM4EALDH1A1TP53 | |
| Hydrochloric Acid SCHEMBL20563713 | 0.73 | ALDH1A1 (0.46) | METCASP6KDM4EALDH1A1TP53 | |
| SCHEMBL13676644 | 0.72 | MET (0.46) | METCASP6ALDH1A1NPC1 | |
| SCHEMBL10162903 | 0.72 | DHFR (0.38) | METCASP6KDM4EALDH1A1TP53 | |
| Ammonia Solution, Strong SCHEMBL28864710 | 0.71 | MET (0.46) | METALDH1A1NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102574853-A | Heterocyclic oxime compounds | NOVARTIS AG | 2012-07-11 | — | — | CN | disclosed |
| WO-2011018454-A1 | HETEROCYCLIC HYDRAZONE COMPOUNDS AND THEIR USES TO TREAT CANCER AND INFLAMMATION | NOVARTIS AG (CH) | 2011-02-17 | — | — | WO | disclosed |