Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 19/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | HTR2C | P28335 | 4/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL742660 | 0.90 | HTR6 (0.53) | HTR6CYP3A4HTR2CHTR2AHTR2B | |
| SCHEMBL740954 | 0.88 | HTR6 (0.49) | HTR6CYP3A4HTR2CHTR2AHTR2B | |
| SCHEMBL743065 | 0.86 | HTR6 (0.42) | HTR6CYP3A4HTR2C | |
| SCHEMBL744059 | 0.85 | HTR6 (0.41) | HTR6CYP3A4HTR2C | |
| SCHEMBL14070202 | 0.85 | HTR6 (0.47) | HTR6CYP3A4HTR2CHTR2AHTR2B | |
| SCHEMBL742225 | 0.85 | HTR6 (0.55) | HTR6CYP3A4HTR2CHTR2AHTR2B | |
| SCHEMBL14070185 | 0.85 | HTR6 (0.50) | HTR6CYP3A4HTR2CHTR2AHTR2B | |
| SCHEMBL741607 | 0.85 | HTR6 (0.53) | HTR6CYP3A4HTR2CHTR2AHTR2B | |
| SCHEMBL741792 | 0.84 | HTR6 (0.46) | HTR6CYP3A4HTR2CHTR2AHTR2B | |
| Trifluoroacetic Acid SCHEMBL744053 | 0.83 | HTR6 (0.46) | HTR6CYP3A4HTR2CADRA2BHTR2A |
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-2008110598-A1 | TRICYCLIC ISOQUINOLINE DERIVATIVES FOR TREATMENT OF OBESITY | BIOVITRUM AB (PUBL) (SE) | 2008-09-18 | — | — | WO | disclosed |