Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | F10 | P00742 | 2/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 4/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10285200 | 0.91 | HSD11B1 (0.35) | KCNH2OPRM1HTR2A | |
| SCHEMBL10285566 | 0.91 | UBE2M (0.36) | KCNH2OPRM1HTR2A | |
| SCHEMBL10285621 | 0.89 | OPRM1 (0.39) | KCNH2OPRM1F10PRSS1PRSS2 | |
| SCHEMBL2800489 | 0.88 | KCNH2 (0.52) | KCNH2OPRM1 | |
| SCHEMBL14279739 | 0.85 | NR1H4 (0.40) | OPRM1THRBHTR2A | |
| SCHEMBL10285571 | 0.84 | CNR2 (0.41) | KCNH2OPRM1THRB | |
| SCHEMBL14279427 | 0.84 | KCNH2 (0.37) | KCNH2OPRM1 | |
| SCHEMBL14279787 | 0.83 | CNR2 (0.45) | KCNH2OPRM1 | |
| SCHEMBL12002164 | 0.83 | KCNH2 (0.46) | KCNH2OPRM1 | |
| SCHEMBL10285281 | 0.83 | KCNH2 (0.36) | KCNH2OPRM1THRBHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2468743-A1 | Nitrogen-containing bicyclic compounds useful as antibacterial agents | Toyama Chemical Co., Ltd. (JP) | 2012-06-27 | — | — | EP | disclosed |
| EP-1900732-A1 | NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF | TOYAMA CHEMICAL CO., LTD. (JP) | 2008-03-19 | — | — | EP | disclosed |