Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 8/20 | 0.63 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.63 |
| ▸ | HTR1A | P08908 | 1/20 | 0.63 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.63 |
| ▸ | ACHE | P22303 | 1/20 | 0.63 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.63 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.63 |
| ▸ | HTR3A | P46098 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL9013932 | 1.00 | HTR4 (0.63) | HTR4KCNH2HTR1AADRA2CACHE | |
| SCHEMBL9013925 | 1.00 | HTR4 (0.63) | HTR4KCNH2HTR1AADRA2CACHE | |
| Water SCHEMBL8828785 | 0.99 | HTR4 (0.62) | HTR4KCNH2HTR1AADRA2CACHE | |
| Water SCHEMBL8828779 | 0.99 | HTR4 (0.62) | HTR4KCNH2HTR1AADRA2CACHE | |
| Water SCHEMBL8828775 | 0.99 | HTR4 (0.62) | HTR4KCNH2HTR1AADRA2CACHE | |
| SCHEMBL8828831 | 0.92 | HTR4 (0.63) | HTR4KCNH2HTR1AADRA2CACHE | |
| SCHEMBL8828838 | 0.92 | HTR4 (0.63) | HTR4KCNH2HTR1AADRA2CACHE | |
| SCHEMBL8828833 | 0.92 | HTR4 (0.63) | HTR4KCNH2HTR1AADRA2CACHE | |
| SCHEMBL8687215 | 0.90 | HTR4 (0.62) | HTR4KCNH2HTR1AADRA2CACHE | |
| SCHEMBL8687217 | 0.90 | HTR4 (0.62) | HTR4KCNH2HTR1AADRA2CACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-5565582-A | GASTROINTESTINAL DISORDERS | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-10-15 | — | — | US | disclosed |
| US-5552553-A | CHEMICAL INTERMEDIATES FOR LAXATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-09-03 | — | — | US | disclosed |