Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 6/20 | 0.47 |
| ▸ | CES1 | P23141 | 6/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | GLS | O94925 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALB | P02768 | 1/20 | 0.32 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27607833 | 0.85 | CES2 (0.44) | CES2CES1CNR2GAAMEN1 | |
| SCHEMBL27806757 | 0.80 | CTSS (0.42) | CNR2 | |
| SCHEMBL28749619 | 0.79 | CES2 (0.44) | CES2CES1BCHEMEN1KMT2A | |
| SCHEMBL28046049 | 0.78 | CYP1A2 (0.44) | MEN1KMT2A | |
| SCHEMBL24978320 | 0.76 | CES2 (0.49) | CES2CES1BCHEGLSCNR2 | |
| SCHEMBL24978371 | 0.76 | CES2 (0.49) | CES2CES1BCHEGLSCNR2 | |
| SCHEMBL27600704 | 0.72 | HTT (0.44) | GLSRIPK1GAA | |
| SCHEMBL27893495 | 0.72 | TSHR (0.48) | HPGDLMNA | |
| SCHEMBL8879212 | 0.72 | CES2 (0.43) | CES2CES1BCHEGLSRIPK1 | |
| SCHEMBL16956837 | 0.72 | CES2 (0.40) | CES2CES1BCHEGLS |
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 |
|---|---|---|---|---|---|---|---|
| CN-106795120-A | New pyridine radicals epoxide and phenyl epoxide pyrazolyl compounds | 豪夫迈·罗氏有限公司 | 2017-05-31 | — | — | CN | disclosed |