Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 8/20 | 0.51 |
| ▸ | GPR119 | Q8TDV5 | 7/20 | 0.51 |
| ▸ | CCR3 | P51677 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 4/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28003341 | 0.87 | CCR3 (0.48) | KCNH2GPR119CCR3CCR5LTA4H | |
| SCHEMBL13478879 | 0.83 | KCNH2 (0.58) | KCNH2GPR119CCR3CCR5DRD2 | |
| SCHEMBL13478882 | 0.80 | KCNH2 (0.67) | KCNH2CCR5DRD2HTR2AHTR2C | |
| SCHEMBL13478881 | 0.79 | KCNH2 (0.56) | KCNH2GPR119CCR5LTA4HDRD2 | |
| SCHEMBL13173159 | 0.79 | KCNH2 (0.42) | KCNH2GPR119CCR3CCR5LTA4H | |
| SCHEMBL13478877 | 0.77 | KCNH2 (0.63) | KCNH2GPR119ALDH1A1SIGMAR1 | |
| SCHEMBL2846152 | 0.77 | KCNH2 (0.41) | KCNH2GPR119CCR3CCR5LTA4H | |
| SCHEMBL13194962 | 0.76 | KCNH2 (0.61) | KCNH2CCR3CCR5DRD2HTR2A | |
| SCHEMBL13478931 | 0.76 | KCNH2 (0.54) | KCNH2GPR119CCR3LTA4HALDH1A1 | |
| SCHEMBL13478887 | 0.75 | CCR5 (0.57) | KCNH2GPR119CCR5LTA4HALDH1A1 |
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-2151439-A1 | NITROGENATED AROMATIC 6-MEMBERED RING DERIVATIVE, AND PHARMACEUTICAL AGENT COMPRISING THE SAME | Asubio Pharma Co., Ltd. (JP) | 2010-02-10 | — | — | EP | disclosed |