Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | LMNA | P02545 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14232244 | 0.86 | ADORA2A (0.43) | KDM4EL3MBTL1ADORA2AADORA1ALDH1A1 | |
| SCHEMBL21890441 | 0.81 | KDM4E (0.50) | KDM4EL3MBTL1ATMADORA2AADORA1 | |
| SCHEMBL23917067 | 0.79 | KDM4E (0.47) | KDM4EL3MBTL1ATMADORA2AALDH1A1 | |
| SCHEMBL22649056 | 0.78 | KDM4E (0.53) | KDM4EL3MBTL1ATMADORA2AADORA1 | |
| SCHEMBL14232243 | 0.78 | KDM4E (0.44) | KDM4EL3MBTL1ATMADORA2AADORA1 | |
| SCHEMBL14231778 | 0.77 | ADORA2A (0.42) | KDM4EL3MBTL1ADORA2AADORA1ALDH1A1 | |
| SCHEMBL19342620 | 0.76 | KDM4E (0.52) | KDM4EL3MBTL1ATMALDH1A1LMNA | |
| SCHEMBL15626835 | 0.76 | KDM4E (0.38) | KDM4EL3MBTL1ATMADORA2AADORA1 | |
| SCHEMBL15626804 | 0.76 | ADORA2A (0.34) | KDM4EL3MBTL1ADORA2AADORA1ALDH1A1 | |
| SCHEMBL15626814 | 0.76 | ADORA2A (0.44) | KDM4EL3MBTL1ADORA2AADORA1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2714841-B1 | ORGANIC ELECTROLUMINESCENCE DEVICE | MERCK PATENT GMBH (DE) | 2016-06-22 | — | — | EP | disclosed |