Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 2/20 | 0.43 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.41 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.41 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 5/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14996629 | 0.83 | NR1H2 (0.44) | ALDH1A1GAAHPGDTHRBL3MBTL1 | |
| SCHEMBL16200060 | 0.83 | THRB (0.52) | ALDH1A1GAAHPGDTHRBNPSR1 | |
| SCHEMBL14996558 | 0.83 | ALDH1A1 (0.52) | ALDH1A1GAAHPGDTHRBL3MBTL1 | |
| SCHEMBL14996607 | 0.80 | TSHR (0.42) | ALDH1A1GAAHPGDTHRBGFER | |
| SCHEMBL16200196 | 0.80 | PDE4D (0.42) | MAPK14MAPK13MAPK12MAPK11ALDH1A1 | |
| SCHEMBL16200063 | 0.80 | ALDH1A1 (0.48) | ALDH1A1THRB | |
| SCHEMBL5255663 | 0.78 | MAPK14 (0.51) | MAPK14MAPK13CSNK1DCSNK1EMAPK12 | |
| SCHEMBL14996631 | 0.77 | MEN1 (0.43) | MAPK14ALDH1A1GAAHPGDTHRB | |
| SCHEMBL16200057 | 0.76 | MAPK14 (0.42) | MAPK14MAPK13CSNK1DCSNK1EMAPK12 | |
| SCHEMBL13184420 | 0.76 | MAP4K4 (0.43) | MAPK14CSNK1DMAPK11ALDH1A1GAA |
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-1720545-B1 | BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES | CHEMOCENTRYX INC (US) | 2014-10-29 | — | — | EP | disclosed |