Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UBE2I | P63279 | 1/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.43 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.43 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.43 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.43 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.42 |
| ▸ | FEN1 | P39748 | 2/20 | 0.42 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6884865 | 0.86 | ALDH1A1 (0.39) | ERCC1FEN1ERCC4PIN1MAPT | |
| SCHEMBL6875960 | 0.85 | RNASEH1 (0.44) | ERCC1FEN1ERCC4PIN1MAPT | |
| SCHEMBL6883723 | 0.84 | RNASEH1 (0.38) | ERCC1FEN1ERCC4PIN1MAPT | |
| SCHEMBL6885410 | 0.83 | PIN1 (0.60) | ERCC1FEN1ERCC4PIN1MAPT | |
| SCHEMBL6883583 | 0.82 | ERCC1 (0.44) | ERCC1FEN1ERCC4PIN1LMNA | |
| SCHEMBL6649378 | 0.81 | ERCC1 (0.58) | ERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6651065 | 0.81 | ERCC1 (0.51) | ERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6886274 | 0.81 | ALOX5 (0.49) | ERCC1FEN1ERCC4PIN1HPGD | |
| SCHEMBL6646945 | 0.81 | ERCC1 (0.50) | ERCC1FEN1ERCC4PIN1 | |
| SCHEMBL6883394 | 0.80 | EGLN1 (0.50) | ERCC1FEN1ERCC4PIN1MAPT |
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 |