Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.50 |
| ▸ | PNMT | P11086 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8595997 | 0.88 | TAAR1 (0.40) | TAAR1PNMTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1822278 | 0.78 | TAAR1 (0.62) | TAAR1PNMTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5541596 | 0.78 | TAAR1 (0.48) | TAAR1PNMTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5535992 | 0.76 | TAAR1 (0.47) | TAAR1PNMTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8811762 | 0.76 | MTNR1A (0.43) | SLC6A2SLC6A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL3788445 | 0.75 | TAAR1 (0.72) | TAAR1PNMTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4771885 | 0.75 | TAAR1 (0.59) | TAAR1PNMTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6014367 | 0.73 | MAOA (0.54) | TAAR1IDO1 | |
| Hydrochloric Acid SCHEMBL28508673 | 0.73 | TAAR1 (0.69) | TAAR1PNMTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6679839 | 0.72 | TAAR1 (0.56) | TAAR1PNMTSLC6A2SLC6A4SLC6A3 |
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-1997002242-A1 | AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS | SMITHKLINE BEECHAM PLC (GB) | 1997-01-23 | — | — | WO | disclosed |