Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JUN | P05412 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.41 |
| ▸ | RELA | Q04206 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 2/20 | 0.39 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.37 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.37 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL29639807 | 0.82 | NFKB1 (0.42) | JUNNFKB1NFKB2RELAKDM4E | |
| SCHEMBL6933248 | 0.75 | MAPK1 (0.46) | MAPK1PIK3CAMAPK8MAPK9MAPK10 | |
| SCHEMBL6933431 | 0.73 | ABL1 (0.48) | ABL1MAPK1 | |
| SCHEMBL9885815 | 0.68 | MAPT (0.56) | KDM4E | |
| SCHEMBL19416867 | 0.67 | RAB9A (0.62) | MAPK1PIK3CAMAPK8MAPK9MAPK10 | |
| SCHEMBL10955770 | 0.66 | MKNK1 (0.45) | ABL1MKNK2 | |
| SCHEMBL24703391 | 0.66 | PIK3CA (0.54) | ABL1MAPK1PIK3CA | |
| SCHEMBL11017429 | 0.66 | KDM4E (0.37) | NFKB1KDM4ESORT1 | |
| SCHEMBL6936291 | 0.66 | KDM4E (0.55) | KDM4EPIK3CAPIK3CD | |
| SCHEMBL29693635 | 0.66 | KDM4E (0.37) | NFKB1KDM4ESORT1 |
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-2011114275-A1 | SPIROCYCLIC COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES | UNIVERSITY OF BASEL (CH) | 2011-09-22 | — | — | WO | disclosed |