Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28744475 | 0.79 | CYP2C19 (0.43) | CYP2C19SLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL952368 | 0.78 | CYP2C19 (0.48) | CYP2C19SLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL14920544 | 0.73 | SLC6A4 (0.65) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8473445 | 0.72 | TACR1 (0.46) | CYP2C19SLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL943620 | 0.69 | SLC6A2 (0.68) | SLC6A2SLC6A4SLC6A3HTR1ACTSL | |
| SCHEMBL110365 | 0.69 | SLC6A2 (0.68) | SLC6A2SLC6A4SLC6A3HTR1ACTSL | |
| SCHEMBL2978516 | 0.69 | SLC6A2 (0.68) | SLC6A2SLC6A4SLC6A3HTR1ACTSL | |
| SCHEMBL8135989 | 0.69 | CTSL (0.43) | CYP2C19SLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL9069886 | 0.69 | CTSL (0.43) | CYP2C19SLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL8798135 | 0.69 | CTSL (0.43) | CYP2C19SLC6A2SLC6A4SLC6A3HTR1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107540601-B | The convenient preparation method of 5R- benzyloxy amino piperidine -2S- formic acid esters and its oxalates | 新发药业有限公司 | 2019-07-19 | — | — | CN | disclosed |
| CN-109970625-A | A kind of preparation method of 5R- benzyloxy amino piperidine -2S- formic acid or derivatives thereof | 新发药业有限公司 | 2019-07-05 | — | — | CN | disclosed |
| CN-107540601-A | The convenient preparation method of 5R benzyloxies amino piperidine 2S formic acid esters and its oxalates | 新发药业有限公司 | 2018-01-05 | — | — | CN | disclosed |