Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 7/20 | 0.44 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 1/20 | 0.38 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21400918 | 0.87 | NR3C2 (0.42) | NR3C2SYKNR3C1MMP12ALDH1A1 | |
| SCHEMBL7980639 | 0.86 | SYK (0.44) | NR3C2SYKNR3C1MMP12KCNH2 | |
| SCHEMBL7977812 | 0.86 | NR3C2 (0.41) | NR3C2SYKNR3C1MMP12ALDH1A1 | |
| SCHEMBL7977814 | 0.83 | NR3C2 (0.41) | NR3C2SYKNR3C1MMP12ALDH1A1 | |
| SCHEMBL7964489 | 0.82 | CYP1A2 (0.43) | NR3C2SYKMMP12KCNH2ALDH1A1 | |
| SCHEMBL7977863 | 0.79 | SYK (0.39) | NR3C2SYKNR3C1MMP12KCNH2 | |
| SCHEMBL7974822 | 0.79 | SYK (0.45) | NR3C2SYKNR3C1ALDH1A1MAPT | |
| SCHEMBL5338733 | 0.75 | NR3C2 (0.44) | NR3C2SYKNR3C1MMP12 | |
| SCHEMBL2489889 | 0.74 | NR3C2 (0.50) | NR3C2NR3C1MMP12ALDH1A1 | |
| SCHEMBL619718 | 0.74 | NR3C2 (0.44) | NR3C2NR3C1MMP12ALDH1A1MAPT |
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-2017137744-A1 | HETEROCYCLIC COMPOUNDS, IN PARTICULAR 2-OXO-4,4,5,5,6,6,7,7-OCTAHYDROBENZOXAZOLE DERIVATIVES, AND THEIR USE AS ANTIBACTERIAL COMPOUNDS | REDX PHARMA PLC (GB) | 2017-08-17 | — | — | WO | disclosed |