Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1959361 | 0.88 | HTR2A (0.47) | HTR2AOPRM1NPY5RSLC6A4TACR1 | |
| SCHEMBL1637914 | 0.81 | HTR2A (0.44) | HTR2AOPRM1NPY5ROPRK1OPRL1 | |
| SCHEMBL1958095 | 0.81 | OPRM1 (0.57) | HTR2AOPRM1NPY5RTACR1USP2 | |
| SCHEMBL5198608 | 0.80 | HTR2A (0.42) | HTR2AOPRM1NPY5ROPRK1OPRL1 | |
| SCHEMBL4780555 | 0.77 | OPRM1 (0.50) | HTR2AOPRM1NPY5ROPRK1OPRL1 | |
| SCHEMBL4534192 | 0.75 | HTR2A (0.47) | HTR2AOPRM1SLC6A2OPRK1OPRL1 | |
| Methyl Alcohol SCHEMBL8520431 | 0.71 | OPRM1 (0.45) | HTR2AOPRM1NPY5ROPRK1OPRL1 | |
| SCHEMBL6071368 | 0.71 | OPRM1 (0.45) | HTR2AOPRM1NPY5ROPRK1OPRL1 | |
| SCHEMBL13233728 | 0.71 | HTR2A (0.52) | HTR2AOPRM1 | |
| SCHEMBL27306600 | 0.70 | OPRM1 (0.43) | HTR2AOPRM1SLC6A2SLC6A4 |
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-106316967-B | The preparation method of West pa lattice intermediate and West pa lattice | 上海艾康睿医药科技有限公司 | 2019-02-05 | — | — | CN | disclosed |
| CN-106467496-A | 4- [(5,6- diphenyl piperazine -2- base)（Isopropyl）Amido]-n-butyl alcohol preparation method | 苏州国匡医药科技有限公司 | 2017-03-01 | — | — | CN | disclosed |
| US-3869460-A | I-adamantyl carbonyl-3,3-diphenylpiperazines | AMERICAN HOME PROD | 1975-03-04 | — | — | US | disclosed |