Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 3/20 | 0.48 |
| ▸ | CTSK | P43235 | 3/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27613700 | 1.00 | CTSS (0.48) | CTSSCTSKHDAC4HDAC1HDAC8 | |
| SCHEMBL8300851 | 0.86 | HDAC4 (0.45) | CTSSCTSKHDAC4HDAC1HDAC8 | |
| SCHEMBL31064845 | 0.86 | AAK1 (0.54) | CTSSCTSKHDAC8MAPTHPGD | |
| SCHEMBL27613652 | 0.85 | HDAC4 (0.61) | CTSSCTSKHDAC4HDAC1HDAC8 | |
| SCHEMBL6767860 | 0.84 | CTSS (0.44) | CTSSCTSKHDAC4HDAC1HDAC8 | |
| SCHEMBL7425030 | 0.82 | CTSS (0.49) | CTSSCTSKHDAC4HDAC1HDAC8 | |
| SCHEMBL6362624 | 0.82 | NPC1 (0.45) | HDAC4HDAC1HDAC8HDAC3HDAC7 | |
| SCHEMBL6362009 | 0.82 | NPC1 (0.45) | HDAC4HDAC1HDAC8HDAC3HDAC7 | |
| SCHEMBL1312367 | 0.79 | SPHK1 (0.60) | CTSKHDAC4HDAC1 | |
| SCHEMBL30377330 | 0.78 | HDAC4 (0.49) | CTSSCTSKHDAC4HDAC1HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100364971-C | Pyrrolidin-2-ones as factor Xa inhibitors | GLAXO GROUP LTD (GB) | 2008-01-30 | — | — | CN | disclosed |
| CN-1620434-A | Pyrrolidine-2-ones as factor Xa inhibitors | GLAXO GROUP LTD (GB) | 2005-05-25 | — | — | CN | disclosed |