Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP3 | O14638 | 1/20 | 0.42 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.42 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.41 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.41 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5546174 | 0.83 | CCR9 (0.44) | MAPK13MAPK12MAPK11MAPK14HPGD | |
| SCHEMBL9434736 | 0.83 | NPC1 (0.39) | MAPK13MAPK12MAPK11MAPK14HPGD | |
| SCHEMBL21051602 | 0.83 | NPC1 (0.40) | MAPK13MAPK12MAPK11MAPK14HPGD | |
| SCHEMBL5545503 | 0.83 | PTGS2 (0.54) | MAPK13MAPK12MAPK11MAPK14SMN1; SMN2 | |
| SCHEMBL1617773 | 0.83 | ACHE (0.43) | MAPK13MAPK12MAPK11MAPK14HPGD | |
| SCHEMBL342242 | 0.83 | MAPK13 (0.58) | MAPK13MAPK12MAPK11MAPK14HPGD | |
| SCHEMBL19626569 | 0.81 | MAPK13 (0.61) | ENPP3ENPP1MAPK13MAPK12MAPK11 | |
| SCHEMBL22925728 | 0.79 | KDM4E (0.48) | ENPP3ENPP1HPGDSMN1; SMN2NPC1 | |
| SCHEMBL8192595 | 0.79 | LMNA (0.43) | MAPK13MAPK12MAPK11MAPK14PTGS2 | |
| SCHEMBL344844 | 0.77 | PTGS2 (0.50) | PTGS2PTGS1KMT2A |
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 |