Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 5/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL28443373 | 0.91 | NPSR1 (0.34) | MAPTNPSR1ALDH1A1DHODHESR1 | |
| SCHEMBL22084944 | 0.88 | NPSR1 (0.37) | MAPTNPSR1ALDH1A1GAAHTT | |
| SCHEMBL28701449 | 0.87 | SLC6A2 (0.35) | MAPTNPSR1 | |
| SCHEMBL28443895 | 0.85 | TP53 (0.41) | MAPTALDH1A1GAAMEN1KMT2A | |
| SCHEMBL22041587 | 0.83 | LMNA (0.43) | MAPTNPSR1ALDH1A1GAAMEN1 | |
| SCHEMBL29659631 | 0.83 | LMNA (0.43) | MAPTNPSR1ALDH1A1GAAMEN1 | |
| SCHEMBL22084259 | 0.81 | CNR2 (0.43) | MAPTNPSR1ALDH1A1GAAHTT | |
| SCHEMBL29814968 | 0.81 | PPARD (0.37) | MAPTNPSR1 | |
| SCHEMBL22084262 | 0.78 | KDM4E (0.37) | MAPTNPSR1ALDH1A1GAAHTT | |
| SCHEMBL22966200 | 0.77 | ALDH1A1 (0.42) | MAPTNPSR1ALDH1A1ESR1ESR2 |
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-110452167-B | Quinoline derivatives, preparation method and application thereof | 东莞市东阳光农药研发有限公司 | 2020-08-21 | — | — | CN | disclosed |