Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 3/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.38 |
| ▸ | PRKDC | P78527 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22707606 | 0.88 | ALOX5 (0.41) | ALDH1A1HSD17B10L3MBTL1ALOX5HPGD | |
| SCHEMBL22708080 | 0.86 | ALOX5 (0.40) | ALDH1A1HSD17B10MAPK1TSHRATM | |
| SCHEMBL27013315 | 0.85 | ALOX5 (0.42) | ALDH1A1HSD17B10MAPK1TSHRATM | |
| SCHEMBL18820563 | 0.84 | ALOX5 (0.44) | ALDH1A1HSD17B10MAPK1TSHRATM | |
| SCHEMBL18820559 | 0.84 | ALOX5 (0.44) | ALDH1A1HSD17B10MAPK1TSHRATM | |
| SCHEMBL27013056 | 0.84 | ALOX5 (0.41) | ALDH1A1HSD17B10MAPK1TSHRATM | |
| SCHEMBL23426674 | 0.83 | ALDH1A1 (0.41) | ALDH1A1HSD17B10L3MBTL1ALOX5HPGD | |
| SCHEMBL24991008 | 0.83 | MAPT (0.38) | ALDH1A1HSD17B10MAPK1TSHRATM | |
| SCHEMBL19770484 | 0.82 | ALDH1A1 (0.39) | ALDH1A1HSD17B10MAPK1TSHRATM | |
| SCHEMBL18820603 | 0.82 | ALOX5 (0.43) | ALDH1A1HSD17B10MAPK1TSHRATM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017071791-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2017-05-04 | — | — | WO | disclosed |