Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | CCKBR | P32239 | 1/20 | 0.34 |
| ▸ | PDE5A | O76074 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6665581 | 0.91 | NNMT (0.43) | NNMTMAOAMAOBOPRK1KCNH2 | |
| SCHEMBL6663534 | 0.91 | NNMT (0.41) | NNMTMAOBOPRK1KCNH2OPRM1 | |
| SCHEMBL6667909 | 0.89 | NNMT (0.40) | NNMTMAOAMAOBOPRK1KCNH2 | |
| SCHEMBL6680821 | 0.85 | ALDH1A1 (0.41) | OPRK1RXRARXRBRXRGNR4A2 | |
| SCHEMBL6665597 | 0.85 | ROCK2 (0.41) | OPRK1RXRARXRBRXRGCSNK2A2 | |
| SCHEMBL6668051 | 0.79 | PTGDR2 (0.43) | NNMTMAOAMAOBOPRK1KCNH2 | |
| SCHEMBL6664526 | 0.78 | PARP10 (0.44) | MAOBNR4A2CCKBRPOLB | |
| SCHEMBL6666927 | 0.76 | MAOA (0.48) | NNMTMAOAMAOBCSNK2A2CSNK2A1 | |
| SCHEMBL6678968 | 0.76 | NR1H2 (0.49) | CCKBRPOLB | |
| SCHEMBL6663962 | 0.75 | ROCK2 (0.46) | CCKBR |
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-2004014388-A1 | 6,6-FUSED HETEROARYL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |