Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.38 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL65232 | 0.89 | TMEM97 (0.37) | PDK1PDK2PDK3PDK4HTR2C | |
| SCHEMBL64234 | 0.86 | L3MBTL1 (0.36) | PDK1PDK2PDK3PDK4MAPT | |
| SCHEMBL64057 | 0.86 | PPARG (0.39) | PDE4BMAPTCHRM2CHRM4CHRM5 | |
| SCHEMBL64676 | 0.82 | PDK1 (0.39) | PDK1PDK2PDK3PDK4POLB | |
| SCHEMBL15341340 | 0.82 | PDK1 (0.45) | PDK1PDK2PDK3PDK4HTR2C | |
| SCHEMBL66855 | 0.81 | ELANE (0.38) | KDM1ARCOR1 | |
| SCHEMBL1058641 | 0.80 | POLB (0.49) | PDK1PDK2PDK3PDK4HTR2C | |
| SCHEMBL1058639 | 0.80 | POLB (0.49) | PDK1PDK2PDK3PDK4HTR2C | |
| SCHEMBL8699830 | 0.80 | POLB (0.49) | PDK1PDK2PDK3PDK4HTR2C | |
| SCHEMBL13340947 | 0.80 | POLB (0.49) | PDK1PDK2PDK3PDK4HTR2C |
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 |