Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4989502 | 0.82 | RAD52 (0.42) | PNMTRAD52RECQLKDM4EALDH1A1 | |
| SCHEMBL14111444 | 0.79 | LIMK1 (0.49) | PNMTKDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL15290670 | 0.77 | CYP2C19 (0.35) | KDM4EALDH1A1GAAHPGDHRH3 | |
| SCHEMBL25680290 | 0.76 | — | — | |
| SCHEMBL4978177 | 0.70 | TLR7 (0.51) | KDM4EALDH1A1MEN1KMT2AHRH3 | |
| SCHEMBL6370338 | 0.70 | PNMT (0.40) | PNMTRAD52RECQLHRH3GRM5 | |
| SCHEMBL4985387 | 0.70 | DRD2 (0.43) | PNMTMAPTKDR | |
| SCHEMBL8369140 | 0.69 | RAD52 (0.45) | PNMTRAD52RECQLKDM4EALDH1A1 | |
| SCHEMBL858540 | 0.69 | RAD52 (0.36) | PNMTRAD52RECQLHSD17B10HRH3 | |
| SCHEMBL13532619 | 0.69 | TSHR (0.37) | KDM4EALDH1A1MEN1HPGDKMT2A |
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-2012068096-A2 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-05-24 | — | — | WO | disclosed |