Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 16/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.69 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9008763 | 1.00 | CCKBR (0.69) | CCKBRKCNH2SCN9A | |
| SCHEMBL9303610 | 1.00 | CCKBR (0.69) | CCKBRKCNH2SCN9A | |
| SCHEMBL8880870 | 1.00 | CCKBR (0.69) | CCKBRKCNH2SCN9A | |
| SCHEMBL8880864 | 1.00 | CCKBR (0.69) | CCKBRKCNH2SCN9A | |
| SCHEMBL8879465 | 1.00 | CCKBR (0.69) | CCKBRKCNH2SCN9A | |
| SCHEMBL8879470 | 1.00 | CCKBR (0.69) | CCKBRKCNH2SCN9A | |
| SCHEMBL4415291 | 0.87 | CCKBR (0.62) | CCKBR | |
| SCHEMBL8824754 | 0.83 | CCKBR (0.59) | CCKBRKCNH2SCN9A | |
| SCHEMBL8824753 | 0.83 | CCKBR (0.59) | CCKBRKCNH2SCN9A | |
| SCHEMBL4418545 | 0.83 | CCKBR (0.59) | CCKBRKCNH2SCN9A |
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-5556969-A | Benzodiazepine derivatives | MERCK SHARP & DOHME LTD. (GB) | 1996-09-17 | — | — | US | disclosed |