Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 4/20 | 0.63 |
| ▸ | HSD17B3 | P37058 | 5/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.63 |
| ▸ | GLA | P06280 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.63 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | AR | P10275 | 1/20 | 0.56 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.56 |
| ▸ | MAP1LC3A | Q9H492 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CASP1 | P29466 | 1/20 | 0.53 |
| ▸ | CASP7 | P55210 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.51 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9211697 | 0.90 | NQO1 (0.54) | NQO1HSD17B3KDM4EGLAGAA | |
| SCHEMBL9208386 | 0.88 | NQO1 (0.56) | NQO1HSD17B3KDM4EGLAGAA | |
| SCHEMBL8806699 | 0.87 | NQO1 (0.52) | NQO1HSD17B3KDM4EGLAGAA | |
| SCHEMBL5072364 | 0.86 | NQO1 (0.71) | NQO1KDM4EALDH1A1TSHR | |
| SCHEMBL9210274 | 0.84 | NQO1 (0.67) | NQO1KDM4EMAPTALDH1A1HPGD | |
| SCHEMBL8808518 | 0.84 | NQO1 (0.61) | NQO1KDM4EALDH1A1TSHR | |
| SCHEMBL8806732 | 0.83 | NQO1 (0.71) | NQO1KDM4EALDH1A1TSHR | |
| SCHEMBL8808047 | 0.83 | NQO1 (0.59) | NQO1ALDH1A1TSHR | |
| SCHEMBL8806304 | 0.82 | NQO1 (0.69) | NQO1KDM4EALDH1A1TSHR | |
| SCHEMBL28646880 | 0.82 | HSD17B3 (0.79) | HSD17B3KDM4EGLAGAANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0758327-A1 | PYRANONE COMPOUNDS USEFUL TO TREAT RETROVIRAL INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1997-02-19 | — | — | EP | disclosed |
| EP-0682663-A1 | 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1995-11-22 | — | — | EP | disclosed |