Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 7/20 | 0.46 |
| ▸ | CTSS | P25774 | 6/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | JAK3 | P52333 | 1/20 | 0.42 |
| ▸ | BTK | Q06187 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.38 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13702236 | 0.85 | CTSK (0.53) | CTSKCTSSHDAC4HDAC1HDAC6 | |
| SCHEMBL30312666 | 0.85 | CTSK (0.53) | CTSKCTSSHDAC4HDAC1HDAC6 | |
| SCHEMBL7973800 | 0.84 | CTSK (0.41) | CTSKCTSSHDAC4HDAC1HDAC6 | |
| SCHEMBL7974823 | 0.83 | ALDH1A1 (0.47) | CTSKCTSSHDAC4HDAC1HDAC6 | |
| SCHEMBL7976998 | 0.83 | CTSK (0.49) | CTSKCTSSHDAC4HDAC1HDAC6 | |
| SCHEMBL7974856 | 0.82 | CTSK (0.43) | CTSKCTSSHDAC4HDAC1HDAC6 | |
| SCHEMBL12081854 | 0.79 | JAK3 (0.68) | CTSKCTSSHDAC4HDAC1HDAC6 | |
| SCHEMBL16383457 | 0.76 | CTSS (0.52) | CTSKCTSSHDAC4HDAC1HDAC6 | |
| SCHEMBL16924919 | 0.75 | CTSK (0.51) | CTSKCTSSHDAC4HDAC1HDAC6 | |
| SCHEMBL7977282 | 0.75 | TDP1 (0.40) | 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 |
|---|---|---|---|---|---|---|---|
| WO-2001005748-A1 | OLIGOMERIC AMINO ACID DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | MONSANTO COMPANY (US) | 2001-01-25 | — | — | WO | disclosed |