Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 6/20 | 0.32 |
| ▸ | ITK | Q08881 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
| ▸ | BTK | Q06187 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | JAK3 | P52333 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | DHODH | Q02127 | 1/20 | 0.30 |
| ▸ | AURKA | O14965 | 1/20 | 0.30 |
| ▸ | GSK3A | P49840 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3633598 | 0.83 | KCNQ3 (0.38) | EGFRITKMDM2BTKSMN1; SMN2 | |
| SCHEMBL3634094 | 0.83 | MDM2 (0.34) | EGFRITKMDM2BTKSMN1; SMN2 | |
| SCHEMBL3630824 | 0.82 | KMT2A (0.36) | EGFRITKMDM2BTKSMN1; SMN2 | |
| SCHEMBL3630762 | 0.82 | KMT2A (0.45) | EGFRMEN1KMT2ANPC1RAB9A | |
| SCHEMBL3633099 | 0.81 | CHRNA7 (0.40) | EGFRITKMDM2BTKSMN1; SMN2 | |
| SCHEMBL3636515 | 0.79 | KDM4E (0.41) | MDM2SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL3945199 | 0.72 | EGFR (0.34) | EGFRITKBTKNPC1RAB9A | |
| SCHEMBL849127 | 0.71 | STAT6 (0.37) | EGFRITKBTK | |
| SCHEMBL27800296 | 0.68 | MAPT (0.45) | EGFRITKMDM2SMN1; SMN2MEN1 | |
| SCHEMBL3635507 | 0.64 | ABL1 (0.34) | EGFRITKMDM2BTKKMT2A |
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-2009015917-A2 | DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK | F. HOFFMANN-LA ROCHE AG (CH) | 2009-02-05 | — | — | WO | disclosed |