Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 8/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.48 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.48 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.48 |
| ▸ | CTSK | P43235 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | DRD5 | P21918 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7020985 | 0.87 | CTSK (0.46) | CTSKDRD2DRD3CTSSCTSV | |
| SCHEMBL7017128 | 0.83 | CTSK (0.44) | HDAC3CTSKCTSSCTSVCTSL | |
| SCHEMBL7019711 | 0.81 | LMNA (0.52) | HDAC1CTSKCTSSCTSVCTSL | |
| SCHEMBL7021109 | 0.81 | CTSK (0.41) | CTSKCTSSCTSVCTSLNPC1 | |
| SCHEMBL7020885 | 0.79 | CTSK (0.43) | NAMPTHDAC1HDAC10HDAC6HDAC8 | |
| SCHEMBL7016446 | 0.79 | HDAC1 (0.48) | NAMPTHDAC1HDAC6CTSKCTSS | |
| SCHEMBL4454112 | 0.76 | CTSK (0.78) | CTSKCTSSCTSVCTSL | |
| SCHEMBL4446520 | 0.75 | CTSK (0.63) | CTSKCTSSCTSVCTSL | |
| SCHEMBL4452896 | 0.75 | CTSS (0.71) | CTSKCTSSCTSVCTSL | |
| SCHEMBL7023221 | 0.74 | HDAC3 (0.41) | HDAC1HDAC3CTSKDRD2DRD4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1362052-A1 | INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | Amura Therapeutics Limited (GB) | 2003-11-19 | — | — | EP | disclosed |
| WO-2002057270-A1 | INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | AMURA THERAPEUTICS LIMITED (GB) | 2002-07-25 | — | — | WO | disclosed |