Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 12/20 | 0.71 |
| ▸ | CTSS | P25774 | 4/20 | 0.44 |
| ▸ | CCR1 | P32246 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 3/20 | 0.38 |
| ▸ | CTSV | O60911 | 2/20 | 0.38 |
| ▸ | CCKBR | P32239 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 2/20 | 0.37 |
| ▸ | TNF | P01375 | 1/20 | 0.37 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4045165 | 0.93 | CTSK (0.61) | CTSKCTSSCCR1CTSLCTSV | |
| SCHEMBL4043955 | 0.91 | CTSK (0.58) | CTSKCTSSCCR1CTSLCTSV | |
| SCHEMBL4042238 | 0.90 | CTSK (0.70) | CTSKCTSSCCR1CTSLCTSV | |
| SCHEMBL4042169 | 0.90 | CTSK (0.67) | CTSKCTSSCCR1CTSLCTSB | |
| SCHEMBL4048280 | 0.89 | CTSK (0.56) | CTSKCTSSCCR1CTSLCTSV | |
| SCHEMBL4044579 | 0.88 | CTSK (0.71) | CTSKCTSSCCR1CTSLCTSV | |
| SCHEMBL4218903 | 0.87 | CTSK (0.80) | CTSKCTSSCCR1HDAC3HDAC4 | |
| SCHEMBL4043715 | 0.87 | CTSK (0.80) | CTSKCTSSCCR1HDAC3HDAC4 | |
| SCHEMBL5942432 | 0.87 | CTSK (0.80) | CTSKCTSSCCR1HDAC3HDAC4 | |
| SCHEMBL4051972 | 0.87 | CTSK (0.54) | CTSKCTSSCCR1CTSLCTSV |
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 |