Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL91250 | 0.82 | PARP1 (0.34) | PDK1PDK2PDK3PDK4CCR5 | |
| SCHEMBL91259 | 0.80 | HTR2C (0.33) | PDK1PDK2PDK3PDK4HTR2C | |
| SCHEMBL78407 | 0.79 | PDK1 (0.37) | PDK1PDK2PDK3PDK4CCR5 | |
| SCHEMBL91189 | 0.77 | PDK1 (0.36) | PDK1PDK2PDK3PDK4CCR5 | |
| SCHEMBL14420341 | 0.77 | HTR2C (0.41) | PDK1PDK2PDK3PDK4HTR2C | |
| SCHEMBL91296 | 0.76 | PDK1 (0.36) | PDK1PDK2PDK3PDK4HTR2C | |
| SCHEMBL64675 | 0.75 | PDK1 (0.38) | PDK1PDK2PDK3PDK4CCR5 | |
| SCHEMBL91275 | 0.74 | PPARG (0.38) | ALDH1A1TSHRL3MBTL1KDM4ELMNA | |
| SCHEMBL91257 | 0.74 | ITGB3 (0.34) | KDM4ELMNA | |
| SCHEMBL78189 | 0.73 | PDK1 (0.38) | PDK1PDK2PDK3PDK4CCR5 |
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 |