Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.51 |
| ▸ | EBP | Q15125 | 2/20 | 0.51 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.51 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | EBPL | Q9BY08 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6625725 | 0.88 | SIGMAR1 (0.63) | SIGMAR1EBPTMEM97ADRA1DADRA1A | |
| Hydrochloric Acid SCHEMBL1332052 | 0.86 | SIGMAR1 (0.61) | SIGMAR1EBPTMEM97ADRA1DADRA1A | |
| SCHEMBL8828170 | 0.83 | SIGMAR1 (0.61) | SIGMAR1EBPTMEM97ADRA1DADRA1A | |
| Tert-Butyl Formate SCHEMBL27925816 | 0.79 | ALDH1A1 (0.43) | SLC6A4 | |
| SCHEMBL13068843 | 0.79 | SIGMAR1 (0.62) | SIGMAR1EBPTMEM97EBPL | |
| SCHEMBL27334031 | 0.74 | SIGMAR1 (0.56) | SIGMAR1EBPTMEM97ADRA1DADRA1A | |
| SCHEMBL11841171 | 0.74 | CYP1A2 (0.57) | SIGMAR1SLC6A4 | |
| SCHEMBL4324560 | 0.74 | CYP1A2 (0.57) | SIGMAR1SLC6A4 | |
| SCHEMBL29756433 | 0.74 | CYP1A2 (0.57) | SIGMAR1SLC6A4 | |
| SCHEMBL2730838 | 0.73 | KCNJ1 (0.60) | SIGMAR1EBPTMEM97SLC6A4 |
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-101448503-B | Piperidine and piperazine derivatives | MS SCIENCE CORP | 2011-04-13 | — | — | CN | disclosed |
| CN-101448503-A | Piperidine and piperazine derivatives | MS SCIENCE CORP (JP) | 2009-06-03 | — | — | CN | disclosed |