Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 6/20 | 0.48 |
| ▸ | CSNK1D | P48730 | 4/20 | 0.47 |
| ▸ | RIPK3 | Q9Y572 | 4/20 | 0.46 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10153132 | 0.74 | ACVR1B (0.52) | MAPK14CLK4MAP4K1 | |
| SCHEMBL319950 | 0.72 | CYP1A2 (0.53) | MAPK14CSNK1DALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL12440313 | 0.69 | CYP1A2 (0.53) | MAPK14CSNK1DALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3241755 | 0.68 | CNR2 (0.56) | ALDH1A1 | |
| SCHEMBL19791404 | 0.67 | MAP4K1 (0.42) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6350323 | 0.67 | MELK (0.57) | CYP11B2CYP1A2MAP4K1 | |
| SCHEMBL17728173 | 0.67 | MAPK14 (0.76) | MAPK14CSNK1DRIPK3MAPK11 | |
| SCHEMBL6354314 | 0.66 | MELK (0.52) | CYP11B2 | |
| SCHEMBL20654148 | 0.65 | CYP11B1 (0.63) | CYP11B1CYP11B2 | |
| SCHEMBL25150589 | 0.65 | RIPK3 (0.52) | RIPK3ALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2590946-A1 | BIPYRIDYL DERIVATIVES USEFUL FOR THE TREATMENT OF KINASE - INDUCED DISEASES | Merck Patent GmbH (DE) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012003912-A1 | BIPYRIDYL DERIVATIVES USEFUL FOR THE TREATMENT OF KINASE - INDUCED DISEASES | MERCK PATENT GMBH (DE) | 2012-01-12 | — | — | WO | disclosed |