Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.56 |
| ▸ | CES1 | P23141 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.42 |
| ▸ | FEN1 | P39748 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6444922 | 0.79 | CES2 (0.65) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL9988312 | 0.79 | CES2 (0.52) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL16952899 | 0.79 | TSHR (0.58) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL890358 | 0.78 | ALDH1A1 (0.42) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL4416667 | 0.77 | CES2 (0.62) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL25680264 | 0.75 | CES2 (0.48) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL25680262 | 0.75 | CES2 (0.48) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL1821100 | 0.74 | CES2 (0.59) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL12268127 | 0.74 | POLB (0.52) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL5408652 | 0.72 | CES2 (0.56) | CES2CES1ALDH1A1POLBTSHR |
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-2011161615-A1 | 5-LIPOXYGENASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2011-12-29 | — | — | WO | disclosed |