Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | 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 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL64061 | 0.92 | CHRM2 (0.38) | CHRM5CHRM1CHRM2CHRM4CHRM3 | |
| SCHEMBL66854 | 0.90 | CHRM2 (0.38) | SMN1; SMN2CHRM5CHRM1CHRM2CHRM4 | |
| SCHEMBL64034 | 0.90 | CHRM5 (0.38) | SMN1; SMN2NPC1ALDH1A1MAPTRAB9A | |
| SCHEMBL91298 | 0.86 | CHRM5 (0.37) | SMN1; SMN2NPC1ALDH1A1MAPTRAB9A | |
| SCHEMBL78781 | 0.83 | KDM4E (0.36) | SMN1; SMN2CHRM5CHRM1CHRM2CHRM4 | |
| SCHEMBL78412 | 0.81 | PPARG (0.39) | SMN1; SMN2NPC1ALDH1A1MAPTRAB9A | |
| SCHEMBL65231 | 0.81 | CHRM5 (0.39) | SMN1; SMN2NPC1ALDH1A1MAPTRAB9A | |
| SCHEMBL78185 | 0.80 | PDK1 (0.40) | NPC1ALDH1A1MAPTRAB9APDK1 | |
| SCHEMBL65084 | 0.79 | REN (0.37) | — | |
| SCHEMBL78635 | 0.77 | PDK1 (0.35) | SMN1; SMN2NPC1ALDH1A1RAB9ACHRM5 |
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 |