Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 5/20 | 0.52 |
| ▸ | FPR2 | P25090 | 2/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | FKBP4 | Q02790 | 1/20 | 0.38 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | APOL1 | O14791 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2170169 | 0.86 | SCN9A (0.54) | SCN9AFPR2DPP4RAB9A | |
| SCHEMBL2355316 | 0.77 | SCN9A (0.52) | SCN9AFPR2DPP4RAB9AHTR1A | |
| SCHEMBL13570422 | 0.76 | CES2 (0.41) | DPP4RAB9ACHRM2CHRM1CHRM3 | |
| SCHEMBL2356691 | 0.74 | SCN9A (0.48) | SCN9AFPR2DPP4RAB9AHTR1A | |
| SCHEMBL6980126 | 0.72 | AGTR2 (0.52) | DPP4 | |
| SCHEMBL2170202 | 0.71 | SCN9A (0.49) | SCN9AFPR2DPP4HTR1AHTR7 | |
| SCHEMBL2364602 | 0.69 | HTR2C (0.45) | CHRM2CHRM1CHRM3PDE4APDE4B | |
| SCHEMBL2172455 | 0.69 | SCN9A (0.60) | SCN9AFPR2DPP4HTR1AHTR7 | |
| Hydrochloric Acid SCHEMBL2169819 | 0.68 | SCN9A (0.59) | SCN9AFPR2DPP4HTR1AHTR7 | |
| SCHEMBL2352727 | 0.68 | SCN9A (0.53) | SCN9AFPR2DPP4HTR1AHTR7 |
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-2346821-A1 | SPHINGOSINE-1-PHOSPHATE RECEPTOR ANTAGONISTS | Exelixis, Inc. (US) | 2011-07-27 | — | — | EP | disclosed |