Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 8/20 | 0.41 |
| ▸ | PKM | P14618 | 4/20 | 0.40 |
| ▸ | PKLR | P30613 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2356115 | 0.90 | MEN1 (0.46) | PKMNR3C1KDM4EALDH1A1TSHR | |
| SCHEMBL14150516 | 0.89 | NR3C1 (0.49) | AKR1C3AKR1C2NR3C1KDM4EALDH1A1 | |
| SCHEMBL2357824 | 0.88 | PKM (0.44) | AKR1C3PKMPKLRAKR1C2NR3C1 | |
| SCHEMBL2354783 | 0.87 | NR3C1 (0.51) | AKR1C3PKMNR3C1ALDH1A1TSHR | |
| SCHEMBL2347062 | 0.85 | AKR1C3 (0.43) | AKR1C3AKR1C2NR3C1KDM4EALDH1A1 | |
| SCHEMBL14150535 | 0.83 | NR3C1 (0.47) | PKMNR3C1KDM4EALDH1A1MEN1 | |
| SCHEMBL2355541 | 0.82 | MEN1 (0.49) | PKMNR3C1KDM4EALDH1A1GAA | |
| SCHEMBL2346588 | 0.82 | CD4 (0.51) | PKMNR3C1ALDH1A1GAATSHR | |
| SCHEMBL2348930 | 0.82 | ALDH1A1 (0.42) | KDM4EALDH1A1TSHRKMT2A | |
| SCHEMBL2356653 | 0.82 | LMNA (0.55) | PKMPKLRNR3C1KDM4EALDH1A1 |
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-2011101805-A1 | PYRAZOLO PIPERIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS | GENKYOTEX SA (CH) | 2011-08-25 | — | — | WO | disclosed |