Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | EDNRB | P24530 | 2/20 | 0.35 |
| ▸ | EDNRA | P25101 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.32 |
| ▸ | DHPS | P49366 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7009624 | 0.79 | EDNRB (0.41) | HTR2ASLC6A4KCNH2CA12CA1 | |
| SCHEMBL7298739 | 0.77 | CDK1 (0.43) | HTR2ASLC6A4KCNH2CA12CA1 | |
| SCHEMBL4435549 | 0.75 | EDNRB (0.44) | HTR2ASLC6A4KCNH2CA12CA1 | |
| SCHEMBL7010336 | 0.73 | DHPS (0.41) | EDNRBEDNRASCN9ADHPSALDH1A1 | |
| SCHEMBL7013160 | 0.72 | EDNRB (0.41) | HTR2ASLC6A4KCNH2CA12CA1 | |
| SCHEMBL4427054 | 0.71 | EDNRB (0.43) | HTR2ASLC6A4KCNH2CA12CA1 | |
| SCHEMBL7329617 | 0.70 | ALDH1A1 (0.40) | HTR2ASLC6A4KCNH2CA12CA1 | |
| SCHEMBL8328086 | 0.69 | ALDH1A1 (0.40) | HTR2ASLC6A4KCNH2CA12CA1 | |
| SCHEMBL4434185 | 0.69 | DHPS (0.42) | HTR2ASLC6A4KCNH2EDNRBEDNRA | |
| SCHEMBL196970 | 0.69 | CA12 (0.62) | HTR2ASLC6A4KCNH2CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5837708-A | CARDIOVASCULAR DISORDERS OF HYPERTENSION, ISCHEMIA, ANGINA PECTORIS AND VASOSPASMS | HOFFMANN-LA ROCHE INC. (US) | 1998-11-17 | — | — | US | disclosed |