Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | ERCC1 | P07992 | 4/20 | 0.36 |
| ▸ | FEN1 | P39748 | 4/20 | 0.36 |
| ▸ | ERCC4 | Q92889 | 4/20 | 0.36 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL6882031 | 0.90 | SLC6A4 (0.36) | RIPK1ATMERCC1FEN1ERCC4 | |
| SCHEMBL6883583 | 0.87 | ERCC1 (0.44) | ATMERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6886242 | 0.85 | HSP90AA1 (0.40) | ATMERCC1FEN1ERCC4RNASEH1 | |
| SCHEMBL6882008 | 0.83 | ERCC1 (0.37) | RIPK1ATMERCC1FEN1ERCC4 | |
| SCHEMBL6884260 | 0.83 | PIN1 (0.41) | ERCC1FEN1ERCC4RNASEH1PIN1 | |
| SCHEMBL6885172 | 0.82 | PIN1 (0.43) | ERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6881498 | 0.81 | PIN1 (0.39) | ERCC1FEN1ERCC4RNASEH1PIN1 | |
| SCHEMBL6886352 | 0.81 | PIN1 (0.46) | ERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6883448 | 0.80 | RNASEH1 (0.44) | ERCC1FEN1ERCC4RNASEH1PIN1 | |
| SCHEMBL6882913 | 0.80 | TACR1 (0.46) | — |
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 |