Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.51 |
| ▸ | RORC | P51449 | 2/20 | 0.48 |
| ▸ | RORB | Q92753 | 2/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.43 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.42 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3048571 | 0.94 | RORB (0.50) | PDK2RORCRORBTRPV1CHRM3 | |
| SCHEMBL4784756 | 0.88 | PDK2 (0.51) | PDK2TRPV1SCN9ASPHK2SPHK1 | |
| SCHEMBL4740974 | 0.84 | TRPV1 (0.54) | RORCRORBTRPV1CHRM3HCRTR1 | |
| SCHEMBL30524817 | 0.81 | PDK2 (0.57) | PDK2SPHK2SPHK1DPP4 | |
| SCHEMBL3048574 | 0.80 | RORB (0.49) | RORCRORBTRPV1CHRM3HCRTR1 | |
| SCHEMBL2930625 | 0.79 | RORB (0.47) | RORCRORBTRPV1CHRM3HCRTR1 | |
| SCHEMBL3063294 | 0.79 | HCRTR2 (0.47) | PDK2SCN9AHCRTR1HCRTR2 | |
| SCHEMBL3058144 | 0.77 | CDK4 (0.46) | CHRM3HCRTR1HCRTR2 | |
| SCHEMBL1398880 | 0.76 | TSHR (0.54) | HCRTR1HCRTR2 | |
| SCHEMBL4683411 | 0.75 | RORB (0.66) | RORCRORB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008087611-A2 | PYRROLIDINE- AND PIPERIDINE- BIS-AMIDE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2008-07-24 | — | — | WO | claimed |
| WO-2008087611-A2 | PYRROLIDINE- AND PIPERIDINE- BIS-AMIDE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2008-07-24 | — | — | WO | disclosed |