Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | CCR6 | P51684 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30438362 | 1.00 | CES2 (0.32) | CES2CES1IDO1TDO2SLC6A2 | |
| SCHEMBL1344441 | 0.86 | — | — | |
| SCHEMBL1344440 | 0.86 | — | — | |
| SCHEMBL27797034 | 0.86 | — | — | |
| SCHEMBL31369161 | 0.86 | APLNR (0.35) | — | |
| SCHEMBL20237986 | 0.83 | SCN1A (0.33) | — | |
| SCHEMBL20237987 | 0.83 | SCN1A (0.33) | — | |
| SCHEMBL20237984 | 0.83 | SCN1A (0.33) | — | |
| SCHEMBL20259227 | 0.83 | SCN1A (0.33) | — | |
| SCHEMBL17041219 | 0.82 | HDAC6 (0.38) | CES2CES1IDO1TDO2SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7947833-B2 | methods that are useful in the preparation of amidophenyl-sulfonylamino-quinoxaline compounds CCK2 modulators are disclosed by sulfonylation | JANSSEN PHARMACEUTICA NV (BE) | 2011-05-24 | — | — | US | disclosed |