Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 11/20 | 0.50 |
| ▸ | CTSK | P43235 | 5/20 | 0.47 |
| ▸ | CCKAR | P32238 | 3/20 | 0.44 |
| ▸ | CCKBR | P32239 | 3/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6305563 | 0.86 | SCN9A (0.47) | SCN9ACCKARCCKBRIDO1 | |
| Hydrochloric Acid SCHEMBL6312630 | 0.80 | NOTCH1 (0.37) | CCKBRIDO1 | |
| SCHEMBL6301463 | 0.79 | SCN9A (0.56) | SCN9ACTSKCCKARCCKBR | |
| SCHEMBL6306657 | 0.77 | SCN9A (0.48) | SCN9ACTSKCCKARCCKBR | |
| SCHEMBL6307701 | 0.74 | SCN9A (0.47) | SCN9ACCKARCCKBRIDO1 | |
| SCHEMBL6306583 | 0.74 | XIAP (0.43) | SCN9ACCKBR | |
| SCHEMBL6309281 | 0.74 | SCN9A (0.52) | SCN9ACTSKCCKARCCKBR | |
| Hydrochloric Acid SCHEMBL6312860 | 0.73 | XIAP (0.42) | SCN9ACCKBR | |
| SCHEMBL4413008 | 0.68 | PSEN1 (0.52) | SCN9ACCKARCCKBR | |
| SCHEMBL26436628 | 0.68 | CTSK (0.79) | CTSK |
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-6958330-B1 | Polycyclic α-amino-ε-caprolactams and related compounds | ELAN PHARMACEUTICALS, INC. (US) | 2005-10-25 | — | — | US | disclosed |