Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL4820038 | 0.76 | CYP2A6 (0.32) | CYP2A6 | |
| SCHEMBL596912 | 0.73 | — | — | |
| SCHEMBL193797 | 0.71 | — | — | |
| SCHEMBL1067603 | 0.68 | DRD1 (0.41) | — | |
| SCHEMBL1066148 | 0.68 | KIF11 (0.37) | — | |
| SCHEMBL147475 | 0.67 | — | — | |
| SCHEMBL1067893 | 0.67 | — | — | |
| SCHEMBL1068211 | 0.67 | CA1 (0.40) | — | |
| SCHEMBL1069188 | 0.65 | — | — | |
| SCHEMBL1067619 | 0.64 | SCN5A (0.38) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117120429-A | KHK inhibitor | 吉利德科学公司 | 2023-11-24 | — | — | CN | disclosed |
| WO-2011006886-A2 | AZOLE COMPOUNDS CARRYING A SULFUR SUBSTITUENT XIV | BASF SE (DE) | 2011-01-20 | — | — | WO | disclosed |
| WO-2010149758-A1 | ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES | BASF SE (DE) | 2010-12-29 | — | — | WO | disclosed |