Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 5/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.39 |
| ▸ | CCR5 | P51681 | 4/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8438015 | 1.00 | KCNJ1 (0.39) | KCNJ1KCNH2CCR5HRH2HRH1 | |
| SCHEMBL8438360 | 0.91 | KCNJ1 (0.38) | KCNJ1KCNH2CCR5HRH2HRH1 | |
| SCHEMBL9126331 | 0.88 | KCNJ1 (0.39) | KCNJ1KCNH2CCR5HRH2HRH1 | |
| SCHEMBL8438315 | 0.88 | KCNJ1 (0.39) | KCNJ1KCNH2CCR5HRH2HRH1 | |
| SCHEMBL8438589 | 0.85 | KCNJ1 (0.42) | KCNJ1KCNH2HRH2HRH1ALDH1A1 | |
| SCHEMBL8536750 | 0.85 | KCNJ1 (0.42) | KCNJ1KCNH2HRH2HRH1ALDH1A1 | |
| SCHEMBL9368164 | 0.85 | ATM (0.37) | KCNJ1KCNH2CCR5ALDH1A1 | |
| SCHEMBL8440034 | 0.85 | KCNJ1 (0.41) | KCNJ1KCNH2HRH2HRH1ALDH1A1 | |
| SCHEMBL9519895 | 0.84 | TDP1 (0.42) | CCR5ALDH1A1 | |
| SCHEMBL10513490 | 0.83 | TDP1 (0.41) | CCR5ALDH1A1 |
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-0518558-B1 | 1-Methylcarbapenem derivatives, their preparation and their use as antibiotics | SANKYO CO (JP) | 1998-09-02 | — | — | EP | disclosed |
| EP-0518558-A1 | 1-Methylcarbapenem derivatives, their preparation and their use as antibiotics | Sankyo Company Limited (JP) | 1992-12-16 | — | — | EP | disclosed |