Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 3/20 | 0.45 |
| ▸ | CES1 | P23141 | 3/20 | 0.45 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9710267 | 0.84 | CES2 (0.45) | KEAP1CES2CES1PARP1DGAT1 | |
| SCHEMBL6227763 | 0.82 | KEAP1 (0.57) | KEAP1CES2CES1MEN1KMT2A | |
| SCHEMBL21154673 | 0.80 | CA2 (0.40) | KEAP1CES2CES1PARP1DGAT1 | |
| SCHEMBL6225041 | 0.80 | CES2 (0.45) | KEAP1CES2CES1POLBALDH1A1 | |
| SCHEMBL29463969 | 0.79 | CES2 (0.52) | KEAP1CES2CES1PARP1DGAT1 | |
| SCHEMBL7017263 | 0.78 | MAPT (0.47) | IKBKBMEN1KMT2ATDP1POLB | |
| SCHEMBL29537903 | 0.77 | CES2 (0.68) | KEAP1CES2CES1PARP1DGAT1 | |
| SCHEMBL366058 | 0.77 | CES2 (0.68) | KEAP1CES2CES1PARP1DGAT1 | |
| SCHEMBL11377040 | 0.76 | KDM4E (0.53) | PARP1ALDH1A1 | |
| SCHEMBL3916230 | 0.75 | ALDH1A1 (0.50) | KEAP1CES2CES1PARP1MEN1 |
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-1992021668-A1 | BENZOTHIAZEPINONES AND THEIR USE AS ANTICONVULSANTS | THE BOOTS COMPANY PLC (GB) | 1992-12-10 | — | — | WO | disclosed |