Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.37 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.37 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | STK10 | O94804 | 1/20 | 0.36 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15892495 | 1.00 | AKR1C3 (0.39) | AKR1C3MAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL29514891 | 0.91 | MAPT (0.46) | MAPK14MAPTGAATDP1KDM4E | |
| SCHEMBL1643477 | 0.91 | MAPT (0.46) | MAPK14MAPTGAATDP1KDM4E | |
| SCHEMBL24969186 | 0.90 | PDK2 (0.40) | AKR1C3MAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL24969183 | 0.90 | PTGER4 (0.37) | AKR1C3MAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL26557500 | 0.89 | MAPK14 (0.37) | AKR1C3MAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL16383445 | 0.88 | SIRT2 (0.46) | AKR1C3MAPTGAATDP1KDM4E | |
| SCHEMBL25124816 | 0.88 | FABP4 (0.43) | PDK2ALDH1A1CDC25BLMNA | |
| SCHEMBL20182303 | 0.88 | MAPT (0.43) | MAPK14MAPTGAATDP1KDM4E | |
| SCHEMBL24968683 | 0.87 | MAPK13 (0.38) | AKR1C3MAPK13MAPK12MAPK11MAPK14 |
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-3596065-B1 | COMPOUNDS WITH ARYLAMINE STRUCTURES | MERCK PATENT GMBH (DE) | 2024-12-25 | — | — | EP | disclosed |
| EP-3535240-B1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2022-11-16 | — | — | EP | disclosed |