Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | LPO | P22079 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | STAT6 | P42226 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4939722 | 0.80 | LMNA (0.47) | KDM4EALDH1A1CYP1A2CYP2C19MAPT | |
| SCHEMBL9223438 | 0.79 | LPO (0.39) | KDM4ELPOMAPK1ALDH1A1CYP2C19 | |
| SCHEMBL28541306 | 0.78 | KDM4E (0.43) | KDM4EMAPK1ALDH1A1CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL8686203 | 0.78 | KDM4E (0.43) | KDM4EMAPK1ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL866289 | 0.73 | LMNA (0.53) | KDM4EALDH1A1CYP1A2CYP2C19MAPT | |
| SCHEMBL15188491 | 0.73 | CTSK (0.44) | HPGDMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6255198 | 0.72 | KDM4E (0.47) | KDM4EMAPK1ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL9530206 | 0.71 | NOTUM (0.62) | KDM4EALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL19546036 | 0.70 | — | — | |
| SCHEMBL11308520 | 0.69 | HSD17B10 (0.41) | KDM4EALDH1A1NPSR1GAAMAPT |
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-2004087661-A1 | PROCESS FOR THE ENANTIOSELECTIVE PRODUCTION OF AN AMINO ACID DERIVATIVE COMPRISING AT LEAST ONE NITROGENOUS HETEROCYCLE | Solvay (Société Anonyme) (BE) | 2004-10-14 | — | — | WO | disclosed |