Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | PRKDC | P78527 | 5/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | CCNC | P24863 | 1/20 | 0.34 |
| ▸ | CDK8 | P49336 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 4/20 | 0.31 |
| ▸ | MAOB | P27338 | 4/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.30 |
| ▸ | AHR | P35869 | 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 | |
|---|---|---|---|---|
| SCHEMBL21184183 | 0.94 | ALOX5 (0.43) | ALOX5PRKDCPIK3CDPIK3CBCCNC | |
| SCHEMBL12925731 | 0.92 | ALOX5 (0.34) | ALOX5PRKDCPIK3CDPIK3CBCCNC | |
| SCHEMBL12925617 | 0.88 | ALOX5 (0.45) | ALOX5PRKDCPIK3CDPIK3CBATM | |
| SCHEMBL10092195 | 0.86 | ALOX5 (0.46) | ALOX5PRKDCPIK3CDPIK3CBATM | |
| SCHEMBL5029897 | 0.84 | ALOX5 (0.43) | ALOX5PRKDCPIK3CDPIK3CBCCNC | |
| SCHEMBL9890191 | 0.82 | MAOA (0.42) | ATMNPC1MAPTMAOAMAOB | |
| SCHEMBL26536780 | 0.81 | ALOX5 (0.50) | ALOX5PRKDCPIK3CDPIK3CBCCNC | |
| SCHEMBL21147907 | 0.81 | ALOX5 (0.50) | ALOX5PRKDCPIK3CDPIK3CBATM | |
| SCHEMBL14770585 | 0.81 | ALOX5 (0.35) | ALOX5PRKDCCCNCCDK8MAOA | |
| SCHEMBL12925613 | 0.81 | MAOA (0.33) | MAOAMAOBACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-20130119360-A1 | ORGANIC ELECTROLUMINESCENCE ELEMENT, NEW COMPOUND FOR THE SAME, DISPLAY DEVICE AND LIGHTING DEVICE USING THE SAME | MERCK PATENT GMBH (DE) | 2013-05-16 | — | — | US | disclosed |