Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 12/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 4/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 10/20 | 0.37 |
| ▸ | CTSB | P07858 | 5/20 | 0.37 |
| ▸ | CTSS | P25774 | 5/20 | 0.37 |
| ▸ | CTSV | O60911 | 2/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4046786 | 0.93 | CHRNB2 (0.36) | CTSKCHRNB2CHRNA7CHRNA4KCNH2 | |
| SCHEMBL4047073 | 0.92 | CHRNB2 (0.43) | CTSKCHRNB2CHRNA7CHRNA4CTSL | |
| SCHEMBL4051337 | 0.89 | CHRNB2 (0.43) | CTSKCHRNB2CHRNA7CHRNA4MMP1 | |
| SCHEMBL4045179 | 0.88 | CTSK (0.44) | CTSKCHRNA7CTSLCTSBCTSS | |
| SCHEMBL4040754 | 0.87 | CTSK (0.40) | CTSKCHRNB2CHRNA7CHRNA4KCNH2 | |
| SCHEMBL4044450 | 0.87 | CTSK (0.43) | CTSKCTSLCTSBCTSS | |
| SCHEMBL4050975 | 0.86 | CTSK (0.43) | CTSKCTSLCTSBCTSSMMP1 | |
| SCHEMBL4050081 | 0.86 | CTSK (0.42) | CTSKCHRNB2CHRNA7CHRNA4CTSL | |
| SCHEMBL4043843 | 0.85 | CTSK (0.41) | CTSKCTSLCTSBCTSSCTSV | |
| SCHEMBL4050866 | 0.85 | CTSK (0.43) | CTSKCHRNB2CHRNA7CHRNA4CTSL |
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 |
|---|---|---|---|---|---|---|---|
| EP-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | claimed |