Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.63 |
| ▸ | HTR3A | P46098 | 2/20 | 0.60 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.60 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.60 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.60 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.60 |
| ▸ | HTR2B | P41595 | 1/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.60 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.60 |
| ▸ | HTR3B | O95264 | 1/20 | 0.60 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.60 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.60 |
| ▸ | CNR1 | P21554 | 3/20 | 0.51 |
| ▸ | CNR2 | P34972 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9049402 | 0.92 | HTR3A (0.71) | NPSR1HTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL13531617 | 0.88 | HTR3A (0.62) | NPSR1HTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL9048709 | 0.86 | HTR3A (0.60) | NPSR1HTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL9049201 | 0.85 | HTR3A (0.63) | NPSR1HTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL9048608 | 0.85 | HTR3A (0.58) | NPSR1HTR3AADRA2AADRA2BADRA2C | |
| Fumaric Acid SCHEMBL9048671 | 0.84 | HTR3A (0.55) | NPSR1HTR3AADRA2AADRA2BADRA2C | |
| Fumaric Acid SCHEMBL9051968 | 0.84 | HTR3A (0.54) | NPSR1HTR3AADRA2AADRA2BADRA2C | |
| Ramosetron SCHEMBL13531398 | 0.83 | HTR3A (0.84) | NPSR1HTR3AADRA2AADRA2BADRA2C | |
| Ramosetron SCHEMBL9048395 | 0.83 | HTR3A (0.84) | NPSR1HTR3AADRA2AADRA2BADRA2C | |
| Ramosetron SCHEMBL2021739 | 0.83 | HTR3A (0.84) | NPSR1HTR3AADRA2AADRA2BADRA2C |
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-0381422-B1 | Tetrahydrobenzimidazole derivatives | YAMANOUCHI PHARMA CO LTD (JP) | 1996-10-23 | — | — | EP | claimed |