Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.54 |
| ▸ | PNMT | P11086 | 2/20 | 0.47 |
| ▸ | CD44 | P16070 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ASIC3 | Q9UHC3 | 4/20 | 0.44 |
| ▸ | PRCP | P42785 | 1/20 | 0.44 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31083722 | 1.00 | HTR2C (0.54) | HTR2CPNMTCD44MAOBHTR2B | |
| SCHEMBL3337529 | 0.84 | ASIC3 (0.51) | HTR2CPNMTHTR2BASIC3 | |
| SCHEMBL18563764 | 0.83 | XDH (0.46) | HTR2BCD274 | |
| SCHEMBL18563768 | 0.78 | XDH (0.46) | HTR2BCD274 | |
| SCHEMBL18729735 | 0.78 | NPC1 (0.43) | HTR2BASIC3 | |
| SCHEMBL17702699 | 0.78 | NOS3 (0.47) | HTR2BASIC3 | |
| SCHEMBL24842403 | 0.76 | CD274 (0.42) | HTR2CPNMTCD44MAOBHTR2B | |
| Hydrochloric Acid SCHEMBL587196 | 0.76 | ASIC3 (0.44) | HTR2CASIC3CD274 | |
| Hydrochloric Acid SCHEMBL587096 | 0.75 | ASIC3 (0.40) | HTR2CPNMTCD44MAOBHTR2B | |
| SCHEMBL6347388 | 0.73 | ASIC3 (0.65) | PNMTCD44MAOBCYP3A4ASIC3 |
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-2023174383-A1 | DIHYDROISOQUINOLINE COMPOUND AND MEDICAL USE THEREOF | 中国科学院上海药物研究所 | 2023-09-21 | — | — | WO | disclosed |