Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.38 |
| ▸ | FEN1 | P39748 | 2/20 | 0.38 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.38 |
| ▸ | DNASE1 | P24855 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 2/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 5/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | PIK3C2G | O75747 | 1/20 | 0.35 |
| ▸ | PRKDC | P78527 | 1/20 | 0.35 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6878396 | 0.94 | PTGES (0.41) | NR1H4ERCC1FEN1ERCC4DNASE1 | |
| SCHEMBL6885380 | 0.90 | PTGES (0.43) | NR1H4ERCC1FEN1ERCC4DNASE1 | |
| SCHEMBL6884277 | 0.88 | NR1H4 (0.41) | NR1H4ERCC1FEN1ERCC4DNASE1 | |
| SCHEMBL6886655 | 0.84 | KMT2A (0.40) | NR1H4ERCC1FEN1ERCC4TP53 | |
| SCHEMBL6885420 | 0.82 | PIN1 (0.40) | ERCC1FEN1ERCC4TACR1PIN1 | |
| SCHEMBL6886280 | 0.80 | HTR7 (0.43) | ERCC1FEN1ERCC4L3MBTL1PIN1 | |
| SCHEMBL6884889 | 0.80 | PIN1 (0.55) | ERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6878297 | 0.79 | PIN1 (0.38) | ERCC1FEN1ERCC4TACR1PIN1 | |
| SCHEMBL6883865 | 0.78 | PIN1 (0.40) | ERCC1FEN1ERCC4TACR1PIN1 | |
| SCHEMBL6881498 | 0.77 | PIN1 (0.39) | ERCC1FEN1ERCC4PIN1 |
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-2004096128-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-11-11 | — | — | WO | disclosed |