Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PPOX | P50336 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.31 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.31 |
| ▸ | TYK2 | P29597 | 1/20 | 0.31 |
| ▸ | JAK3 | P52333 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 2/20 | 0.31 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.31 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10033129 | 0.88 | PPOX (0.36) | CYP11B1CYP11B2ALDH1A1ALOX5APFEN1 | |
| SCHEMBL10033128 | 0.87 | ALOX5AP (0.36) | CYP11B1CYP11B2ALDH1A1ALOX5APFEN1 | |
| SCHEMBL10033112 | 0.85 | BRD4 (0.42) | ALDH1A1ALOX5APFEN1KDM4ETSHR | |
| SCHEMBL10033098 | 0.84 | ALOX5AP (0.39) | CYP11B1CYP11B2ALDH1A1ALOX5APFEN1 | |
| SCHEMBL10033106 | 0.81 | HTR2A (0.38) | CYP11B1CYP11B2ALDH1A1ALOX5APFEN1 | |
| SCHEMBL10033113 | 0.81 | L3MBTL1 (0.42) | CYP11B1CYP11B2ALDH1A1ALOX5APFEN1 | |
| SCHEMBL10033104 | 0.80 | MEN1 (0.38) | ALDH1A1L3MBTL1KDM4EMAPK1NPSR1 | |
| SCHEMBL10033095 | 0.79 | L3MBTL1 (0.41) | ALDH1A1ALOX5APFEN1L3MBTL1PPOX | |
| SCHEMBL12418257 | 0.76 | GAA (0.39) | ALDH1A1L3MBTL1POLBCYP1A2 | |
| SCHEMBL10033130 | 0.74 | TACR1 (0.41) | CYP11B1CYP11B2ALDH1A1KDM4EMAPK1 |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |