Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.55 |
| ▸ | DRD2 | P14416 | 5/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | DRD4 | P21917 | 6/20 | 0.49 |
| ▸ | DRD3 | P35462 | 6/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | MC4R | P32245 | 1/20 | 0.47 |
| ▸ | PNMT | P11086 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12798134 | 0.81 | SIGMAR1 (0.55) | SIGMAR1DRD2HTR1AHTR2AHTT | |
| SCHEMBL1076822 | 0.80 | SIGMAR1 (0.53) | SIGMAR1DRD2HTR1AHTR2AHTT | |
| SCHEMBL8830945 | 0.80 | SIGMAR1 (0.53) | SIGMAR1DRD2HTR1AHTR2AHTT | |
| SCHEMBL2395932 | 0.80 | DRD4 (0.67) | SIGMAR1DRD2HTR1AHTR2AHTT | |
| SCHEMBL8831136 | 0.79 | SIGMAR1 (0.52) | SIGMAR1DRD2HTR1AHTR2AHTT | |
| SCHEMBL5242533 | 0.79 | SLC6A4 (0.53) | SIGMAR1DRD2HTR1AHTR2AHTT | |
| SCHEMBL6263887 | 0.79 | SIGMAR1 (0.52) | SIGMAR1DRD2HTR1AHTR2AHTT | |
| SCHEMBL10287534 | 0.78 | SIGMAR1 (0.71) | SIGMAR1DRD2HTR1AHTR2AHTT | |
| SCHEMBL23063982 | 0.77 | SIGMAR1 (0.50) | SIGMAR1DRD2HTR1AHTR2AHTT | |
| SCHEMBL6585625 | 0.77 | DRD4 (0.63) | SIGMAR1DRD2HTR1AHTR2AHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105566368-B | A kind of method of the borate of synthesis N substituted piperidines 4 | 沧州普瑞东方科技有限公司 | 2017-09-15 | — | — | CN | disclosed |
| CN-105566368-A | Synthesis method of N-substituted piperidine-4-borate | CANGZHOU PURUI DONGFANG SCIENCE & TECH CO LTD | 2016-05-11 | — | — | CN | disclosed |