Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1170436 | 0.93 | NPSR1 (0.34) | NPSR1MAP3K12ALDH1A1ERCC1FEN1 | |
| SCHEMBL12777960 | 0.87 | KDM4E (0.36) | ALDH1A1KDM4E | |
| SCHEMBL1169614 | 0.86 | MAP3K12 (0.34) | MAP3K12ERCC1FEN1ERCC4 | |
| SCHEMBL1169812 | 0.80 | L3MBTL1 (0.36) | ALDH1A1KDM4EMAPK1 | |
| SCHEMBL14303989 | 0.79 | KMT2A (0.36) | NPSR1MAP3K12ALDH1A1KDM4EMAPK1 | |
| SCHEMBL14303988 | 0.79 | HSD11B1 (0.35) | NPSR1ALDH1A1ERCC1FEN1ERCC4 | |
| SCHEMBL5528388 | 0.78 | ERCC1 (0.33) | MAP3K12ERCC1FEN1ERCC4 | |
| SCHEMBL14511045 | 0.78 | MAP3K12 (0.32) | MAP3K12ERCC1FEN1ERCC4 | |
| SCHEMBL13917379 | 0.76 | KCNH2 (0.54) | NPSR1ALDH1A1ERCC1FEN1ERCC4 | |
| SCHEMBL13917632 | 0.74 | KCNK3 (0.42) | — |
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-2008002959-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-01-03 | — | — | WO | disclosed |