Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.69 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.67 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.67 |
| ▸ | CCR5 | P51681 | 7/20 | 0.63 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.63 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.63 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL6705240 | 0.93 | KCNH2 (0.62) | OPRM1CHRM2CHRM3CCR5KCNH2 | |
| SCHEMBL2768189 | 0.90 | KCNH2 (0.80) | CCR5KCNH2GPR119 | |
| SCHEMBL7601798 | 0.86 | L3MBTL1 (0.64) | OPRM1CCR5MEN1KMT2ACHRM1 | |
| SCHEMBL9654034 | 0.86 | OPRM1 (0.67) | OPRM1CHRM2CHRM3CCR5SIGMAR1 | |
| SCHEMBL9653759 | 0.84 | OPRM1 (0.65) | OPRM1CHRM2CHRM3CCR5SIGMAR1 | |
| SCHEMBL5049557 | 0.83 | L3MBTL1 (0.74) | CCR5SIGMAR1MEN1KMT2ACHRM1 | |
| SCHEMBL4025012 | 0.83 | CCR5 (0.81) | CCR5CHRM1HTR2A | |
| SCHEMBL5049480 | 0.82 | L3MBTL1 (0.76) | CCR5MEN1KMT2ACHRM1HTR2A | |
| SCHEMBL6499959 | 0.82 | CCR8 (0.68) | OPRM1CCR5KCNH2SIGMAR1MEN1 | |
| SCHEMBL9651081 | 0.81 | OPRM1 (0.61) | OPRM1CHRM2CHRM3CCR5SIGMAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101412692-B | 1-(3-amino propyl) piperidine-4-aminoamide compounds, and pharmaceutical composition, preparation and use thereof | SHANGHAI INST MATERIA MEDICA | 2012-10-17 | — | — | CN | disclosed |
| CN-101412692-A | 1-(3-amino propyl) piperidine-4-aminoamide compounds, and pharmaceutical composition, preparation and use thereof | SHANGHAI INST MATERIA MEDICA (CN) | 2009-04-22 | — | — | CN | disclosed |
| EP-1948629-A1 | SUBSTITUTED PIPERAZINES AND PIPERIDINES AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-07-30 | — | — | EP | disclosed |
| WO-2007053436-A1 | SUBSTITUTED PIPERAZINES AND PIPERIDINES AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-05-10 | — | — | WO | disclosed |