Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.47 |
| ▸ | TSHR | P16473 | 6/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 11/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3719191 | 0.89 | IDH1 (0.50) | EGFRKDM4ELMNAALDH1A1HSD17B10 | |
| SCHEMBL7071513 | 0.85 | IDH1 (0.51) | EGFRKDM4ETSHRALDH1A1MEN1 | |
| SCHEMBL7073150 | 0.84 | KDM4E (0.63) | KDM4ETSHRLMNARECQLALDH1A1 | |
| SCHEMBL8306652 | 0.82 | KDM4E (0.59) | KDM4ETSHRALDH1A1MEN1KMT2A | |
| SCHEMBL3709499 | 0.81 | IDH1 (0.49) | KDM4ETSHRALDH1A1MEN1KMT2A | |
| SCHEMBL25317005 | 0.79 | ALDH1A1 (0.49) | KDM4ETSHRLMNARECQLALDH1A1 | |
| SCHEMBL3712923 | 0.79 | KDM4E (0.51) | KDM4ETSHRALDH1A1MEN1KMT2A | |
| SCHEMBL3714361 | 0.76 | KDM4E (0.50) | KDM4ETSHRLMNAALDH1A1MEN1 | |
| SCHEMBL24373361 | 0.76 | CHEK1 (0.51) | EGFRKDM4ETSHRLMNARECQL | |
| SCHEMBL29478893 | 0.76 | CHEK1 (0.51) | EGFRKDM4ETSHRLMNARECQL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2393806-A1 | INHIBITORS OF JUN N-TERMINAL KINASE | Elan Pharmaceuticals Inc. (US) | 2011-12-14 | — | — | EP | disclosed |
| WO-2010091310-A1 | INHIBITORS OF JUN N-TERMINAL KINASE | ELAN PHARMACEUTICALS, INC. (US) | 2010-08-12 | — | — | WO | disclosed |