Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 5/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.50 |
| ▸ | HTR3A | P46098 | 2/20 | 0.50 |
| ▸ | MPO | P05164 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR1E | P28566 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | HTR5A | P47898 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6311570 | 0.90 | QDPR (0.51) | SLC6A2SLC6A4SLC6A3KCNH2HTR1A | |
| SCHEMBL8299607 | 0.83 | SLC6A2 (0.61) | SLC6A2SLC6A4SLC6A3KCNH2HTR3A | |
| SCHEMBL10126292 | 0.83 | SLC6A2 (0.61) | SLC6A2SLC6A4SLC6A3KCNH2HTR3A | |
| SCHEMBL2937820 | 0.82 | HTR3A (0.66) | HTR3AMPO | |
| SCHEMBL1828844 | 0.82 | HTR3A (0.66) | HTR3AMPO | |
| SCHEMBL1707108 | 0.82 | HTR3A (0.66) | HTR3AMPO | |
| Hydrochloric Acid SCHEMBL1919231 | 0.80 | HTR3A (0.63) | HTR3AMPO | |
| Hydrochloric Acid SCHEMBL21201476 | 0.80 | HTR3A (0.63) | HTR3AMPO | |
| Hydrochloric Acid SCHEMBL29051162 | 0.80 | HTR3A (0.63) | HTR3AMPO | |
| SCHEMBL13975332 | 0.79 | DRD2 (0.51) | SLC6A2SLC6A4SLC6A3HTR3AMPO |
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-2010123006-A1 | PYRROLIDINE COMPOUND | 武田薬品工業株式会社 (JP) | 2010-10-28 | — | — | WO | disclosed |