Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31456082 | 0.86 | GLP1R (0.48) | NPSR1SMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL2407562 | 0.82 | GLP1R (0.51) | SMN1; SMN2KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL6386134 | 0.81 | SMN1; SMN2 (0.56) | NPSR1SMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL9822756 | 0.79 | KDM4E (0.43) | SMN1; SMN2KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL2407572 | 0.77 | KDM4E (0.48) | KDM4EALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL2408256 | 0.76 | NPSR1 (0.61) | NPSR1SMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL14725585 | 0.73 | NPSR1 (0.52) | NPSR1SMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL5925834 | 0.73 | NPSR1 (0.42) | NPSR1SMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL2409818 | 0.71 | NPSR1 (0.54) | NPSR1SMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL15900342 | 0.71 | NPSR1 (0.54) | NPSR1SMN1; SMN2KDM4EALDH1A1MAPT |
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-110592157-B | Method for synthesizing quinoxaline compound by double-protein catalytic cascade reaction | 吉林大学 | 2021-01-01 | — | — | CN | disclosed |
| CN-110592157-A | Method for synthesizing quinoxaline compound by double-protein catalytic cascade reaction | 吉林大学 | 2019-12-20 | — | — | CN | disclosed |