Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL316737 | 0.81 | ALDH1A1 (0.52) | ALDH1A1POLBMAPK14MAPK1MAPT | |
| SCHEMBL2856262 | 0.79 | ALDH1A1 (0.59) | ALDH1A1POLBMAPK14MAPK1MAPT | |
| SCHEMBL315499 | 0.78 | HSD11B1 (0.42) | ALDH1A1MAPTTP53HSD11B1 | |
| SCHEMBL315859 | 0.76 | MAPT (0.47) | ALDH1A1POLBMAPK14MAPK1MAPT | |
| SCHEMBL316233 | 0.75 | ALDH1A1 (0.49) | ALDH1A1POLBMAPK14MAPK1MAPT | |
| SCHEMBL2985751 | 0.75 | CCR3 (0.53) | MAPT | |
| SCHEMBL15889273 | 0.73 | POLB (0.58) | ALDH1A1POLBMAPK1MAPTGAA | |
| SCHEMBL18016194 | 0.73 | ALDH1A1 (0.52) | ALDH1A1POLBMAPK14MAPK1MAPT | |
| SCHEMBL13793363 | 0.71 | MCHR1 (0.63) | ALDH1A1MAPK1MAPTGAA | |
| SCHEMBL1402778 | 0.71 | HSD11B1 (0.72) | ALDH1A1MAPK14MAPK1MAPTGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8093272-B2 | Heteroaryl substituted cyclohexyl-1,4-diamine compounds | GRUENENTHAL GMBH (DE) | 2012-01-10 | — | — | US | claimed |
| US-8093272-B2 | Heteroaryl substituted cyclohexyl-1,4-diamine compounds | GRUENENTHAL GMBH (DE) | 2012-01-10 | — | — | US | disclosed |