Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PPARD | Q03181 | 2/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1167244 | 0.83 | PIN1 (0.58) | PIN1 | |
| SCHEMBL1398803 | 0.83 | PTGS2 (0.50) | HCRTR1 | |
| SCHEMBL1166974 | 0.83 | IKBKB (0.44) | IKBKBMAPT | |
| SCHEMBL4742519 | 0.82 | MAPT (0.52) | MAPTDHODH | |
| SCHEMBL15507084 | 0.81 | RAB9A (0.44) | SRD5A2 | |
| SCHEMBL1167223 | 0.81 | MAPK13 (0.50) | MAPTPIN1PTPN1HCRTR1 | |
| SCHEMBL19256168 | 0.80 | HSD17B10 (0.40) | MAPTPIN1PTPN1HCRTR1 | |
| SCHEMBL1167143 | 0.80 | NPC1 (0.45) | IKBKB | |
| SCHEMBL8192595 | 0.78 | LMNA (0.43) | MAPTPTPN1TRPV1 | |
| SCHEMBL7695161 | 0.78 | IKBKB (0.50) | IKBKBMAPTPPARDPTPN1PPARG |
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 1 patent. 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 | disclosed |