Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MAOA | P21397 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10129515 | 0.82 | KDM4E (0.43) | KDM4ESMN1; SMN2MAOAALDH1A1HPGD | |
| SCHEMBL4092984 | 0.78 | KDM4E (0.41) | KDM4ESMN1; SMN2MAOAALDH1A1HPGD | |
| SCHEMBL13799991 | 0.78 | KDM4E (0.41) | KDM4ESMN1; SMN2MAOAALDH1A1HPGD | |
| SCHEMBL5071042 | 0.78 | EYA3 (0.48) | KDM4ESMN1; SMN2MAOAALDH1A1HPGD | |
| SCHEMBL21358498 | 0.78 | KDM4E (0.41) | KDM4ESMN1; SMN2MAOAALDH1A1HPGD | |
| SCHEMBL28572904 | 0.77 | NQO1 (0.45) | KDM4ESMN1; SMN2CASP7CA12CA2 | |
| SCHEMBL24756284 | 0.76 | KDM4E (0.39) | KDM4ESMN1; SMN2MAOAALDH1A1HPGD | |
| SCHEMBL2845027 | 0.76 | KDM4E (0.39) | KDM4ESMN1; SMN2ALDH1A1HSD17B10MAPT | |
| SCHEMBL2845026 | 0.76 | KDM4E (0.39) | KDM4ESMN1; SMN2ALDH1A1HSD17B10MAPT | |
| SCHEMBL10362259 | 0.74 | PTPN1 (0.42) | KDM4EALDH1A1HSD17B10KCNH2CA12 |
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-2009118163-A1 | (HETERO-)ARYL CYCLOHEXANE DERIVATIVES | Grünenthal GmbH (DE) | 2009-10-01 | — | — | WO | disclosed |