Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PFKFB3 | Q16875 | 13/20 | 0.39 |
| ▸ | PFKFB1 | P16118 | 12/20 | 0.39 |
| ▸ | PFKFB2 | O60825 | 10/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | PSMB8 | P28062 | 2/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 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 | |
|---|---|---|---|---|
| SCHEMBL10119595 | 0.87 | SCN3A (0.43) | PFKFB3PFKFB1PFKFB2HDAC3HDAC4 | |
| SCHEMBL873706 | 0.84 | PFKFB2 (0.42) | PFKFB3PFKFB1PFKFB2HDAC3HDAC4 | |
| SCHEMBL871886 | 0.82 | SCN3A (0.39) | PFKFB3PFKFB1PFKFB2HDAC3HDAC4 | |
| SCHEMBL872815 | 0.82 | PSMB8 (0.38) | PFKFB3PFKFB1PFKFB2HDAC3HDAC4 | |
| SCHEMBL845510 | 0.79 | SCN3A (0.54) | PFKFB3PFKFB1PFKFB2HDAC3HDAC4 | |
| SCHEMBL872886 | 0.78 | KDM4E (0.52) | PFKFB3PFKFB1PFKFB2 | |
| SCHEMBL10119687 | 0.77 | CYP2C9 (0.44) | PFKFB3PFKFB1PFKFB2HDAC8PSMB8 | |
| SCHEMBL844873 | 0.76 | NPC1 (0.63) | HDAC8SCN3ASCN9ASCN5A | |
| SCHEMBL845110 | 0.75 | ALDH1A1 (0.48) | PFKFB3PFKFB1PFKFB2 | |
| SCHEMBL10119355 | 0.74 | LMNA (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |