Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | MC5R | P33032 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 2/20 | 0.41 |
| ▸ | CCR3 | P51677 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 3/20 | 0.40 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL873810 | 0.89 | PARP1 (0.55) | PARP1MC4RMC5RDPP4CCR3 | |
| SCHEMBL4710881 | 0.89 | PARP1 (0.48) | PARP1DPP4NR1H2NR1H3CA1 | |
| SCHEMBL27904548 | 0.82 | PARP1 (0.46) | PARP1DPP4NR1H2NR1H3CA1 | |
| SCHEMBL873250 | 0.82 | PARP1 (0.46) | PARP1DPP4NR1H2NR1H3CA1 | |
| SCHEMBL3697218 | 0.81 | DPP4 (0.47) | PARP1MC4RMC5RDPP4TACR1 | |
| SCHEMBL25913721 | 0.81 | DPP4 (0.47) | PARP1MC4RMC5RDPP4TACR1 | |
| SCHEMBL7985625 | 0.79 | PARP1 (0.49) | PARP1NR1H2NR1H3CA1CA2 | |
| SCHEMBL874539 | 0.79 | PARP1 (0.54) | PARP1CCR3NR1H2NR1H3CA1 | |
| SCHEMBL31218931 | 0.79 | PARP1 (0.44) | PARP1MC4RMC5RNR1H2NR1H3 | |
| SCHEMBL4315865 | 0.78 | PARP1 (0.49) | PARP1DPP4CCR3TACR1DPP7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006039974-A1 | METHOD FOR THE PRODUCTION OF MONOSUBSTITUTED PIPERAZINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2006-04-20 | — | — | WO | disclosed |