Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 4/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.39 |
| ▸ | PRKX | P51817 | 1/20 | 0.39 |
| ▸ | NEK4 | P51957 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | CSNK1G2 | P78368 | 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 | |
|---|---|---|---|---|
| SCHEMBL12788601 | 0.93 | ALDH1A1 (0.44) | CYP26A1KMT2AKDM4EMEN1ALDH1A1 | |
| SCHEMBL13564411 | 0.86 | TERT (0.40) | KMT2AKDM4EMEN1GSK3BCSNK1G2 | |
| SCHEMBL12788455 | 0.84 | KDM4E (0.42) | KMT2AKDM4EMEN1MAPK1ALDH1A1 | |
| SCHEMBL12846923 | 0.83 | KDM4E (0.42) | KMT2AKDM4EMEN1MAPK1ALDH1A1 | |
| SCHEMBL12788464 | 0.80 | IP6K1 (0.47) | KMT2AKDM4EMEN1ALDH1A1HSD17B10 | |
| SCHEMBL12789612 | 0.79 | KDM4E (0.39) | KMT2AKDM4EMEN1ALDH1A1HSD17B10 | |
| SCHEMBL12788865 | 0.79 | KDM4C (0.36) | KDM4EMAPK1ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL12788570 | 0.79 | NPC1 (0.51) | KMT2AKDM4EMEN1MAPK1ALDH1A1 | |
| SCHEMBL12788312 | 0.78 | KDM4E (0.50) | KMT2AKDM4EMEN1ALDH1A1HSD17B10 | |
| SCHEMBL12788621 | 0.78 | KDM4C (0.38) | MAPK1ALDH1A1LMNA |
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-2297117-B1 | BICYCLIC HETEROCYCLE DERIVATIVES AND USE THEREOF AS GPR119 MODULATORS | MERCK SHARP & DOHME (US) | 2012-10-31 | — | — | EP | disclosed |