Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 6/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL65202 | 0.92 | MGLL (0.36) | CHRM5CHRM1CHRM2CHRM4CHRM3 | |
| SCHEMBL65685 | 0.90 | CHRM5 (0.40) | CHRM5CHRM1CHRM2CHRM4CHRM3 | |
| SCHEMBL78635 | 0.88 | PDK1 (0.35) | CHRM5CHRM1CHRM2CHRM4CHRM3 | |
| SCHEMBL78366 | 0.84 | PDK1 (0.33) | PDK1PDK2PDK3PDK4NPSR1 | |
| SCHEMBL64233 | 0.83 | CHRM5 (0.35) | CHRM5CHRM1CHRM2CHRM4CHRM3 | |
| SCHEMBL64056 | 0.82 | PPARG (0.38) | CHRM5CHRM1CHRM2CHRM4CHRM3 | |
| SCHEMBL78622 | 0.81 | SMN1; SMN2 (0.38) | CHRM5CHRM1CHRM2CHRM4CHRM3 | |
| SCHEMBL64675 | 0.81 | PDK1 (0.38) | ALDH1A1MAPTPDK1PDK2PDK3 | |
| SCHEMBL65367 | 0.80 | REN (0.38) | — | |
| SCHEMBL78404 | 0.78 | PDK1 (0.35) | CHRM5CHRM1CHRM2CHRM4CHRM3 |
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 |