Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 1/20 | 0.47 |
| ▸ | PABPC1 | P11940 | 2/20 | 0.46 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | GLP1R | P43220 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30753428 | 1.00 | NT5E (0.47) | NT5EPABPC1PIK3R1PIK3CABACE1 | |
| SCHEMBL27428014 | 0.87 | NT5E (0.41) | NT5EPABPC1PIK3R1PIK3CABACE1 | |
| SCHEMBL28634341 | 0.79 | PABPC1 (0.58) | PABPC1PIK3R1PIK3CABACE1MAPT | |
| SCHEMBL30179258 | 0.79 | PABPC1 (0.58) | PABPC1PIK3R1PIK3CABACE1MAPT | |
| SCHEMBL483060 | 0.79 | PABPC1 (0.58) | PABPC1PIK3R1PIK3CABACE1MAPT | |
| SCHEMBL30753425 | 0.77 | KDM4E (0.53) | NT5EPABPC1BACE1KDM4EMAPT | |
| SCHEMBL25220529 | 0.76 | NT5E (0.41) | NT5EPABPC1BACE1KDM4EHTT | |
| SCHEMBL31052303 | 0.76 | NT5E (0.41) | NT5EPABPC1BACE1KDM4EHTT | |
| SCHEMBL30753421 | 0.75 | NQO2 (0.57) | KDM4EMAPTHTTCYP1A2GAA | |
| SCHEMBL30753420 | 0.75 | KDM4E (0.49) | PIK3R1PIK3CAKDM4EMAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-106554320-A | Condensed ring aromatic hydrocarbon derivative with quinoxaline group and application thereof | 北京鼎材科技有限公司 | 2017-04-05 | — | — | CN | disclosed |