Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 2/20 | 0.41 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.40 |
| ▸ | FEN1 | P39748 | 2/20 | 0.40 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | USP1 | O94782 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6878297 | 0.87 | PIN1 (0.38) | PIN1ERCC1FEN1ERCC4KMT2A | |
| SCHEMBL6883811 | 0.86 | RNASEH1 (0.41) | PIN1ALDH1A1LMNAMAPT | |
| SCHEMBL6885308 | 0.85 | PIN1 (0.38) | PIN1ALDH1A1LMNAMAPT | |
| SCHEMBL6885442 | 0.85 | PIN1 (0.43) | PIN1ERCC1FEN1ERCC4ATM | |
| SCHEMBL6883233 | 0.84 | ATM (0.39) | PIN1ERCC1FEN1ERCC4ATM | |
| SCHEMBL6884321 | 0.84 | HSD17B1 (0.44) | PIN1ERCC1FEN1ERCC4ATM | |
| SCHEMBL6885410 | 0.82 | PIN1 (0.60) | PIN1ERCC1FEN1ERCC4ATM | |
| SCHEMBL6883225 | 0.81 | PIN1 (0.40) | PIN1ERCC1FEN1ERCC4ATM | |
| SCHEMBL6883583 | 0.79 | ERCC1 (0.44) | PIN1ERCC1FEN1ERCC4ATM | |
| SCHEMBL6883394 | 0.79 | EGLN1 (0.50) | PIN1ERCC1FEN1ERCC4ATM |
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 |