Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | LCAT | P04180 | 2/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.47 |
| ▸ | DPP4 | P27487 | 1/20 | 0.45 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.45 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | ACACB | O00763 | 4/20 | 0.43 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.43 |
| ▸ | PHGDH | O43175 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30582911 | 0.87 | HRH3 (0.52) | HRH3LCATGRIN2BDPP4DPP9 | |
| SCHEMBL1351805 | 0.84 | HTR3E (0.60) | HRH3LCATGRIN2BDPP4DPP9 | |
| Hydrochloric Acid SCHEMBL5220893 | 0.83 | HTR3E (0.59) | HRH3LCATGRIN2BDPP4DPP9 | |
| SCHEMBL13059660 | 0.82 | PRKCQ (0.54) | HRH3LCATGRIN2BDPP4DPP9 | |
| SCHEMBL17667869 | 0.82 | GRIN2B (0.49) | HRH3LCATGRIN2BDPP4DPP9 | |
| SCHEMBL15918310 | 0.82 | GRIN2B (0.49) | HRH3LCATGRIN2BDRD2DRD3 | |
| SCHEMBL17062040 | 0.81 | HRH3 (0.50) | HRH3LCATGRIN2BDPP4DPP9 | |
| SCHEMBL31497599 | 0.81 | HRH3 (0.50) | HRH3LCATGRIN2BDPP4DPP9 | |
| SCHEMBL31497592 | 0.81 | HRH3 (0.50) | HRH3LCATGRIN2BDPP4DPP9 | |
| SCHEMBL22668979 | 0.80 | GRIN2B (0.48) | HRH3GRIN2BDRD2DRD3PHGDH |
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 |
|---|---|---|---|---|---|---|---|
| EP-1940821-A2 | NOVEL VANILLOID RECEPTOR LIGANDS AND THEIR USE FOR PRODUCING MEDICAMENTS | Grünenthal GmbH (DE) | 2008-07-09 | — | — | EP | disclosed |
| WO-2007045462-A2 | NOVEL VANILLOID RECEPTOR LIGANDS AND THEIR USE FOR PRODUCING MEDICAMENTS | Grünenthal GmbH (DE) | 2007-04-26 | — | — | WO | disclosed |