Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 5/20 | 0.63 |
| ▸ | CTSK | P43235 | 5/20 | 0.63 |
| ▸ | CTSL | P07711 | 4/20 | 0.63 |
| ▸ | CTSB | P07858 | 1/20 | 0.63 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | WNT1 | P04628 | 3/20 | 0.40 |
| ▸ | GSK3B | P49841 | 3/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5591156 | 0.94 | CTSS (0.56) | CTSSCTSKCTSLCTSBRORC | |
| SCHEMBL5591423 | 0.91 | CTSS (0.76) | CTSSCTSKCTSLCTSBHDAC3 | |
| SCHEMBL5591381 | 0.87 | CTSL (0.60) | CTSSCTSKCTSLCTSB | |
| SCHEMBL5591471 | 0.87 | CTSS (0.69) | CTSSCTSKCTSLCTSBHDAC6 | |
| SCHEMBL3165448 | 0.86 | CTSS (0.52) | CTSSCTSKCTSLCTSBRORC | |
| SCHEMBL5591574 | 0.86 | CTSS (0.63) | CTSSCTSKCTSLCTSBGSK3B | |
| SCHEMBL3174606 | 0.86 | CTSS (0.55) | CTSSCTSKCTSLCTSBRORC | |
| Trifluoroacetic Acid SCHEMBL5591441 | 0.86 | CTSS (0.69) | CTSSCTSKCTSLCTSBHDAC6 | |
| SCHEMBL3159651 | 0.86 | CTSS (0.51) | CTSSCTSKCTSLCTSBRORC | |
| SCHEMBL3166071 | 0.85 | CTSS (0.54) | CTSSCTSKCTSLCTSBRORC |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007025774-A2 | CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2007-03-08 | — | — | WO | claimed |
| WO-2007025774-A2 | CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2007-03-08 | — | — | WO | disclosed |
| WO-2007025774-A2 | CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2007-03-08 | — | — | WO | disclosed |