Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 5/20 | 0.44 |
| ▸ | PREP | P48147 | 2/20 | 0.40 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | CCKBR | P32239 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16622374 | 0.94 | CTSC (0.44) | CTSCPREPHTRA1MEN1KMT2A | |
| SCHEMBL15081689 | 0.92 | CTSC (0.45) | CTSCPREPHTRA1KMT2AMAPK1 | |
| SCHEMBL15081647 | 0.91 | CTSC (0.42) | CTSCPREPHTRA1MAPK1HSD11B1 | |
| SCHEMBL16622332 | 0.90 | CTSC (0.45) | CTSCPREPHTRA1KMT2AMAPK1 | |
| SCHEMBL16622350 | 0.90 | CTSC (0.43) | CTSCPREPHTRA1KMT2AMAPK1 | |
| SCHEMBL15081676 | 0.90 | HTRA1 (0.44) | CTSCPREPHTRA1MAPK1 | |
| SCHEMBL16622349 | 0.89 | CTSC (0.46) | CTSCPREPHTRA1KMT2AMAPK1 | |
| SCHEMBL16622356 | 0.89 | CTSC (0.47) | CTSCPREPHTRA1KMT2AMAPK1 | |
| SCHEMBL16622347 | 0.88 | CTSC (0.45) | CTSCPREPHTRA1KMT2AMAPK1 | |
| SCHEMBL16622375 | 0.88 | CTSC (0.45) | CTSCPREPHTRA1KMT2AMAPK1 |
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-8999975-B2 | Substituted N- [1-cyano-2- (phenyl) ethyl] -2-azabicyclo [2.2.1] heptane-3-carboxamide inhibitors of cathepsin C | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2015-04-07 | — | — | US | disclosed |