Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.33 |
| ▸ | PLA2G7 | Q13093 | 2/20 | 0.33 |
| ▸ | TSPO | P30536 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | NPY1R | P25929 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18398185 | 0.89 | JAK2 (0.36) | ALDH1A1SMN1; SMN2CCNE2CCNE1CDK2 | |
| SCHEMBL18398450 | 0.83 | KDM4E (0.38) | ALDH1A1SMN1; SMN2CCNE2CCNE1CDK2 | |
| SCHEMBL18398276 | 0.77 | NSD2 (0.34) | ALDH1A1SMN1; SMN2CCNE2CCNE1CDK2 | |
| SCHEMBL18409169 | 0.76 | JAK2 (0.43) | SMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL18398537 | 0.74 | CTSL (0.44) | ALDH1A1CCNE2CCNE1CDK2KDM4E | |
| SCHEMBL18409146 | 0.73 | CCNE2 (0.42) | ALDH1A1SMN1; SMN2CCNE2CCNE1CDK2 | |
| SCHEMBL18409435 | 0.68 | JAK2 (0.37) | — | |
| SCHEMBL18398407 | 0.68 | CCNE2 (0.37) | ALDH1A1SMN1; SMN2CCNE2CCNE1CDK2 | |
| SCHEMBL18398457 | 0.67 | CCNE2 (0.35) | ALDH1A1SMN1; SMN2CCNE2CCNE1CDK2 | |
| SCHEMBL16909273 | 0.67 | L3MBTL1 (0.50) | ALDH1A1SMN1; SMN2CCNE2CCNE1CDK2 |
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-2017012647-A1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF INFLAMMATORY DISORDERS | GALAPAGOS NV (BE) | 2017-01-26 | — | — | WO | disclosed |