Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 2/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | HRH2 | P25021 | 2/20 | 0.32 |
| ▸ | HRH1 | P35367 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL65813 | 0.92 | PPARG (0.40) | CHRM5CHRM1KCNH2HRH3HRH2 | |
| SCHEMBL78781 | 0.91 | KDM4E (0.36) | CHRM5CHRM1ESR1ESR2POLB | |
| SCHEMBL64196 | 0.83 | GHSR (0.36) | CHRM5CHRM1 | |
| SCHEMBL64034 | 0.80 | CHRM5 (0.38) | CHRM5CHRM1CYP3A4POLBMAPT | |
| SCHEMBL64233 | 0.76 | CHRM5 (0.35) | CHRM5CHRM1CYP3A4POLBMAPT | |
| SCHEMBL64456 | 0.75 | PPARG (0.39) | CHRM5CHRM1 | |
| SCHEMBL65299 | 0.75 | LTA4H (0.35) | CYP3A4KCNH2HRH3ESR1ESR2 | |
| SCHEMBL66854 | 0.74 | CHRM2 (0.38) | CHRM5CHRM1POLBTP53L3MBTL1 | |
| SCHEMBL78724 | 0.72 | KDM4E (0.34) | CHRM5CHRM1MAPTL3MBTL1 | |
| SCHEMBL91270 | 0.71 | PPARG (0.38) | CHRM5CHRM1POLBTP53L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8129538-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-06 | — | — | US | disclosed |