Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | HPGD | P15428 | 5/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | USP14 | P54578 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22563684 | 0.94 | PDE9A (0.35) | NPSR1KDM4EHSD17B10THRBABCG2 | |
| SCHEMBL23487305 | 0.91 | NPSR1 (0.37) | NPSR1KDM4EAURKAKDRAURKB | |
| SCHEMBL19942705 | 0.90 | NPSR1 (0.34) | NPSR1KDM4EHSD17B10THRBAURKA | |
| SCHEMBL19909130 | 0.89 | AURKA (0.34) | NPSR1KDM4EHSD17B10THRBAURKA | |
| SCHEMBL23487671 | 0.89 | ABL1 (0.34) | NPSR1KDM4EHSD17B10THRBAURKA | |
| SCHEMBL23487667 | 0.88 | ABCG2 (0.39) | KDM4EHSD17B10ABCG2ALDH1A1HPGD | |
| SCHEMBL22563586 | 0.88 | KDM4A (0.41) | KDM4EHSD17B10MAPK1ABCG2ALDH1A1 | |
| SCHEMBL23487302 | 0.88 | KDM5B (0.40) | NPSR1KDM4EHSD17B10AURKAKDR | |
| SCHEMBL23296403 | 0.87 | ADORA1 (0.39) | NPSR1KDM4EHSD17B10THRBALDH1A1 | |
| SCHEMBL22563679 | 0.86 | KDM4E (0.32) | NPSR1KDM4EHSD17B10ABCG2ALDH1A1 |
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-3580300-B1 | ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-10-21 | — | — | EP | disclosed |