Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.58 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CFTR | P13569 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23143494 | 0.88 | ALOX5 (0.58) | ALOX5TRPA1LMNATSHRALDH1A1 | |
| SCHEMBL2445972 | 0.84 | ALOX5 (0.45) | ALOX5TRPA1LMNATSHRALDH1A1 | |
| SCHEMBL2442681 | 0.84 | ALOX5 (0.45) | ALOX5TRPA1LMNATSHRALDH1A1 | |
| SCHEMBL28085954 | 0.83 | AHR (0.47) | ALOX5ALDH1A1HSD17B10KDM4EAHR | |
| SCHEMBL2447960 | 0.82 | ALOX5 (0.43) | ALOX5TRPA1LMNATSHRALDH1A1 | |
| SCHEMBL2445893 | 0.82 | ALOX5 (0.49) | ALOX5TRPA1LMNATSHRALDH1A1 | |
| SCHEMBL1639672 | 0.82 | SMYD3 (0.53) | ALOX5TRPA1LMNATSHRALDH1A1 | |
| SCHEMBL14444038 | 0.81 | ALOX5 (0.54) | ALOX5TRPA1ALDH1A1HSD17B10KDM4E | |
| SCHEMBL2442631 | 0.81 | TRPA1 (0.45) | ALOX5TRPA1LMNATSHRALDH1A1 | |
| SCHEMBL13425531 | 0.81 | ALOX5 (0.47) | ALOX5TRPA1LMNATSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9356243-B2 | Materials for organic electroluminescent devices | MERCK PATENT GMBH (DE) | 2016-05-31 | — | — | US | disclosed |
| US-20140350243-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCH PATENT GMBH (DE) | 2014-11-27 | — | — | US | disclosed |