Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.52 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | RET | P07949 | 2/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | SPR | P35270 | 1/20 | 0.37 |
| ▸ | F13A1 | P00488 | 1/20 | 0.37 |
| ▸ | TGM2 | P21980 | 1/20 | 0.37 |
| ▸ | TGM1 | P22735 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2960207 | 0.85 | HDAC1 (0.49) | CHRNB2CHRNA4HDAC1GPR119PARP1 | |
| SCHEMBL2949364 | 0.85 | GPR119 (0.48) | CHRNB2CHRNA4HDAC1GPR119PARP1 | |
| SCHEMBL11963191 | 0.85 | GPR119 (0.48) | CHRNB2CHRNA4HDAC1GPR119PARP1 | |
| SCHEMBL7001601 | 0.83 | GPR119 (0.52) | CHRNB2CHRNA4HDAC1GPR119PARP1 | |
| SCHEMBL5041416 | 0.83 | CHRNB2 (0.62) | CHRNB2CHRNA4HDAC1 | |
| SCHEMBL5043514 | 0.83 | CHRNB2 (0.62) | CHRNB2CHRNA4HDAC1 | |
| SCHEMBL2958457 | 0.79 | GPR119 (0.48) | CHRNB2CHRNA4HDAC1GPR119PARP1 | |
| SCHEMBL3050128 | 0.79 | GPR119 (0.47) | HDAC1GPR119PARP1HSD11B1RET | |
| SCHEMBL3050124 | 0.79 | GPR119 (0.47) | HDAC1GPR119PARP1HSD11B1RET | |
| SCHEMBL38661622 | 0.78 | GPR119 (0.52) | HDAC1GPR119PARP1HSD11B1RET |
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-1359152-A2 | Diazabicyclic derivatives as nicotinic acetylcholine receptor ligands | ABBOTT LABORATORIES (US) | 2003-11-05 | — | — | EP | disclosed |