Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.41 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.41 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | PDE2A | O00408 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 2/20 | 0.37 |
| ▸ | CD38 | P28907 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6882914 | 0.87 | TACR1 (0.45) | ERCC1FEN1ERCC4PDE2A | |
| SCHEMBL6882033 | 0.84 | P2RX7 (0.42) | P2RX7ERCC1FEN1ERCC4PPARG | |
| SCHEMBL6884591 | 0.74 | ERCC1 (0.50) | ERCC1FEN1ERCC4PPARGMMP13 | |
| SCHEMBL6018064 | 0.72 | KCNE1 (0.44) | P2RX7PTGER4HCRTR1HCRTR2PPARG | |
| SCHEMBL6884192 | 0.72 | PIN1 (0.37) | ERCC1FEN1ERCC4 | |
| SCHEMBL6017819 | 0.72 | LMNA (0.48) | PTGESMMP13 | |
| SCHEMBL6651068 | 0.70 | ERCC1 (0.52) | ERCC1FEN1ERCC4PDE2A | |
| SCHEMBL4235813 | 0.67 | PTGER4 (0.45) | P2RX7PTGER4HCRTR1HCRTR2PTGES | |
| SCHEMBL6649380 | 0.67 | ERCC1 (0.54) | ERCC1FEN1ERCC4PDE2A | |
| SCHEMBL6885131 | 0.67 | ERCC1 (0.46) | ERCC1FEN1ERCC4PTGES |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004096128-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-11-11 | — | — | WO | claimed |
| WO-2004096128-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-11-11 | — | — | WO | disclosed |