Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.38 |
| ▸ | FEN1 | P39748 | 2/20 | 0.38 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL6886326 | 0.92 | ERCC1 (0.36) | ATMERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6878302 | 0.91 | RNASEH1 (0.40) | ERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6884448 | 0.84 | PIN1 (0.41) | ATMERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6885442 | 0.80 | PIN1 (0.43) | ATMERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6649378 | 0.79 | ERCC1 (0.58) | ERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6885410 | 0.79 | PIN1 (0.60) | ATMERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6884321 | 0.79 | HSD17B1 (0.44) | ATMERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6646945 | 0.78 | ERCC1 (0.50) | ERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6886274 | 0.78 | ALOX5 (0.49) | ERCC1FEN1ERCC4PIN1ALDH1A1 | |
| SCHEMBL6883583 | 0.78 | ERCC1 (0.44) | ATMERCC1FEN1ERCC4PIN1 |
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 |