Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.31 |
| ▸ | HPGD | P15428 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PPARD | Q03181 | 1/20 | 0.30 |
| ▸ | PPARA | Q07869 | 1/20 | 0.30 |
| ▸ | RORC | P51449 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5229304 | 0.91 | ALDH1A1 (0.33) | ALDH1A1HPGDKDM4EHSD17B10MAPT | |
| SCHEMBL5226173 | 0.86 | SMO (0.38) | ALDH1A1HPGDKDM4EHSD17B10MAPT | |
| SCHEMBL5222928 | 0.83 | SMO (0.38) | ALDH1A1HPGDKDM4EHSD17B10MAPT | |
| SCHEMBL5226844 | 0.81 | SIGMAR1 (0.34) | ALDH1A1HPGDKDM4EHSD17B10MAPT | |
| SCHEMBL5225471 | 0.80 | HRH3 (0.35) | KDM4EPPARDPPARA | |
| SCHEMBL5224853 | 0.79 | HSD17B10 (0.43) | ALDH1A1HPGDKDM4EHSD17B10LMNA | |
| SCHEMBL5226667 | 0.78 | DRD4 (0.39) | ALDH1A1KDM4ETSHR | |
| SCHEMBL5230408 | 0.77 | SLC2A1 (0.32) | ALDH1A1HPGDHSD17B10MAPTLMNA | |
| SCHEMBL5224717 | 0.77 | NPBWR1 (0.45) | ALDH1A1HPGDKDM4EHSD17B10MAPT | |
| SCHEMBL5224947 | 0.76 | ALDH1A1 (0.38) | ALDH1A1HPGDKDM4EHSD17B10MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |