Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL5309 | 0.97 | — | — | |
| SCHEMBL21177747 | 0.95 | CYP2A6 (0.35) | CYP2A6ALOX12 | |
| SCHEMBL510807 | 0.69 | CYP2A6 (0.44) | CYP2A6 | |
| SCHEMBL15062395 | 0.69 | — | — | |
| SCHEMBL4459896 | 0.67 | CYP2A6 (0.43) | CYP2A6 | |
| SCHEMBL16289083 | 0.67 | CYP1A2 (0.43) | — | |
| SCHEMBL5543787 | 0.67 | CYP2A6 (0.43) | CYP2A6 | |
| SCHEMBL1204761 | 0.67 | CYP2A6 (0.43) | CYP2A6 | |
| SCHEMBL4462774 | 0.67 | CYP1A2 (0.43) | CYP2A6 | |
| SCHEMBL16290161 | 0.67 | CYP1A2 (0.43) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104395326-B | Process for producing borinic acid derivative and novel borinic acid derivative | 玛耐科股份有限公司 | 2017-04-05 | — | — | CN | disclosed |
| CN-104395326-A | Process for producing borinic acid derivative and novel borinic acid derivative | MANAC INC | 2015-03-04 | — | — | CN | disclosed |