Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.33 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | STK17B | O94768 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27847877 | 0.87 | NFE2L2 (0.31) | NFE2L2CYP11B2CYP11B1ALDH1A1MAPT | |
| SCHEMBL27744280 | 0.86 | NFE2L2 (0.43) | NFE2L2CYP11B2CYP11B1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27744207 | 0.83 | CHRNB2 (0.39) | NFE2L2ALDH1A1SMN1; SMN2GAACYP19A1 | |
| SCHEMBL27744008 | 0.81 | CHRNB2 (0.36) | NFE2L2CYP11B2CYP11B1ALDH1A1NTSR1 | |
| Fumaric Acid SCHEMBL27723433 | 0.79 | AKR1C4 (0.38) | NFE2L2NTSR1MEN1KMT2A | |
| SCHEMBL29724169 | 0.78 | GAA (0.41) | CYP11B2CYP11B1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL28054375 | 0.78 | GAA (0.41) | CYP11B2CYP11B1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL27744007 | 0.76 | NFE2L2 (0.42) | NFE2L2CYP11B2CYP11B1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27723332 | 0.76 | CYP2D6 (0.34) | NFE2L2CYP11B2CYP11B1KDM4ECYP19A1 | |
| SCHEMBL27723265 | 0.76 | SLC22A12 (0.36) | NFE2L2CYP11B2CYP11B1GAATBXAS1 |
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-104860923-A | Vonoprazan fumarate preparation method | SHANDONG KANGMEILE PHARMACEUTICAL TECHNOLOGY CO LTD | 2015-08-26 | — | — | CN | disclosed |