Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 1/20 | 0.47 |
| ▸ | FEN1 | P39748 | 1/20 | 0.47 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.47 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | AADAT | Q8N5Z0 | 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 | |
|---|---|---|---|---|
| SCHEMBL6651068 | 0.78 | ERCC1 (0.52) | ERCC1FEN1ERCC4EGLN1SMN1; SMN2 | |
| SCHEMBL7156067 | 0.78 | ERCC1 (0.47) | ERCC1FEN1ERCC4EGLN1SMN1; SMN2 | |
| SCHEMBL6884591 | 0.76 | ERCC1 (0.50) | ERCC1FEN1ERCC4EGLN1SMN1; SMN2 | |
| SCHEMBL6649380 | 0.76 | ERCC1 (0.54) | ERCC1FEN1ERCC4EGLN1SMN1; SMN2 | |
| SCHEMBL6885131 | 0.75 | ERCC1 (0.46) | ERCC1FEN1ERCC4EGLN1SMN1; SMN2 | |
| SCHEMBL6883225 | 0.74 | PIN1 (0.40) | ERCC1FEN1ERCC4PIN1ALDH1A1 | |
| SCHEMBL6883870 | 0.74 | EZH2 (0.39) | PIN1 | |
| SCHEMBL6884704 | 0.74 | ERCC1 (0.49) | ERCC1FEN1ERCC4 | |
| SCHEMBL6017938 | 0.74 | KCNE1 (0.48) | ERCC1FEN1ERCC4SMN1; SMN2KMT2A | |
| SCHEMBL6645450 | 0.73 | SMN1; SMN2 (0.42) | ERCC1FEN1ERCC4EGLN1SMN1; SMN2 |
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 |