Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | FURIN | P09958 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.36 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL10187268 | 0.91 | PARP10 (0.48) | HRH1PARP10HRH3EPHX2ALDH1A1 | |
| SCHEMBL12260856 | 0.89 | PARP10 (0.47) | HRH1PARP10HRH3EPHX2ALDH1A1 | |
| SCHEMBL18620969 | 0.85 | HRH1 (0.66) | HRH1HRH3SLC6A2SLC6A3CHRNB2 | |
| SCHEMBL20686997 | 0.78 | CHRNB2 (0.53) | HRH1SLC6A2MAP4K4CHRNB2CHRNA4 | |
| SCHEMBL6903727 | 0.77 | TDP1 (0.50) | HRH1PARP10HRH3PTPN1SLC6A4 | |
| SCHEMBL19154836 | 0.76 | HRH3 (0.53) | HRH3SMN1; SMN2 | |
| SCHEMBL7943168 | 0.75 | HRH1 (0.43) | HRH1PARP10HRH3PTPN1SLC6A4 | |
| SCHEMBL16838744 | 0.75 | SMN1; SMN2 (0.56) | HRH1PARP10HRH3EPHX2ALDH1A1 | |
| SCHEMBL9572108 | 0.75 | EPHX2 (0.57) | HRH1PARP10EPHX2 | |
| SCHEMBL9641576 | 0.75 | HRH1 (0.43) | HRH1PARP10HRH3PTPN1SLC6A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012032014-A1 | ETHYNE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-03-15 | — | — | WO | disclosed |
| WO-2012001107-A1 | PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-01-05 | — | — | WO | disclosed |