Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QDPR | P09417 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9568917 | 0.91 | QDPR (0.38) | QDPR | |
| SCHEMBL9568964 | 0.88 | QDPR (0.36) | QDPR | |
| SCHEMBL9568968 | 0.87 | QDPR (0.40) | QDPR | |
| SCHEMBL9103505 | 0.87 | QDPR (0.40) | QDPR | |
| Oxalic Acid SCHEMBL9568879 | 0.87 | CHRNB2 (0.37) | QDPR | |
| SCHEMBL11084386 | 0.85 | QDPR (0.39) | QDPR | |
| Hydrochloric Acid SCHEMBL11084396 | 0.85 | QDPR (0.39) | QDPR | |
| SCHEMBL14340657 | 0.85 | QDPR (0.39) | QDPR | |
| SCHEMBL14340659 | 0.84 | QDPR (0.38) | QDPR | |
| SCHEMBL14340658 | 0.82 | QDPR (0.37) | QDPR |
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-5780051-A | Methods and articles of manufacture for nicotine cessation and monitoring nicotine use | DYNAGEN, INC. (US) | 1998-07-14 | — | — | US | disclosed |