Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.46 |
| ▸ | MAPT | P10636 | 7/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | APAF1 | O14727 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3715876 | 0.89 | EGFR (0.53) | EGFRKDM4EALDH1A1HSD17B10MAPT | |
| SCHEMBL3714361 | 0.87 | KDM4E (0.50) | IDH1FLT3KDM4EALDH1A1HSD17B10 | |
| SCHEMBL3713356 | 0.83 | GRIN2D (0.44) | IDH1FLT3KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8306652 | 0.82 | KDM4E (0.59) | KDM4EALDH1A1HSD17B10MAPTGAA | |
| SCHEMBL31472119 | 0.82 | FLT3 (0.50) | EGFRFLT3MAPTSMN1; SMN2 | |
| SCHEMBL3718863 | 0.79 | KDM4E (0.55) | KDM4EALDH1A1HSD17B10MAPTGAA | |
| SCHEMBL13664670 | 0.78 | GRIA1 (0.47) | IDH1FLT3KDM4EALDH1A1HSD17B10 | |
| SCHEMBL3709826 | 0.77 | GABRA1 (0.41) | IDH1KDM4EALDH1A1HSD17B10MAPT | |
| SCHEMBL7071513 | 0.77 | IDH1 (0.51) | IDH1EGFRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL31146008 | 0.76 | KDM4E (0.50) | EGFRKDM4EALDH1A1HSD17B10MAPT |
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 |