Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 3/20 | 0.37 |
| ▸ | PPARG | P37231 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ELAVL1 | Q15717 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.32 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | IL6 | P05231 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL382663 | 0.91 | ADORA1 (0.37) | PPARAPPARGHTTFFAR1KDM4E | |
| SCHEMBL8029952 | 0.81 | ADORA1 (0.43) | PPARAPPARGHTTFFAR1KDM4E | |
| SCHEMBL10195690 | 0.79 | PPARA (0.42) | PPARAPPARGFFAR1KDM4EALDH1A1 | |
| SCHEMBL12163801 | 0.76 | PPARA (0.36) | PPARAPPARGFFAR1KDM4EALDH1A1 | |
| SCHEMBL10195769 | 0.76 | ADORA1 (0.54) | ADORA1 | |
| SCHEMBL8030218 | 0.75 | ELAVL1 (0.41) | KDM4EALDH1A1MAPTELAVL1ADORA1 | |
| SCHEMBL12163910 | 0.72 | ADORA1 (0.43) | PPARAPPARGFFAR1KDM4EALDH1A1 | |
| SCHEMBL12164096 | 0.71 | ADORA1 (0.39) | PPARAPPARGHTTFFAR1KDM4E | |
| SCHEMBL10194562 | 0.71 | ADORA1 (0.51) | ADORA1MEN1KMT2A | |
| SCHEMBL8038927 | 0.70 | ADORA1 (0.46) | ADORA1 |
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-2235011-B1 | SUBSTITUTED PYRROLO[2, 3-B]AND PYRAZOLO[3, 4-B]PYRIDINES FOR USE AS ADENOSINE RECEPTOR LIGANDS | Bayer Pharma AG (DE) | 2012-01-25 | — | — | EP | disclosed |