Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 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 | |
|---|---|---|---|---|
| SCHEMBL31176212 | 0.83 | KDM4E (0.59) | KDM4EHSD17B10HPGDTSHRABCB1 | |
| SCHEMBL8937817 | 0.83 | KDM4E (0.59) | KDM4EHSD17B10HPGDTSHRABCB1 | |
| SCHEMBL3159306 | 0.77 | HSD17B10 (0.52) | KDM4EHSD17B10HPGDTSHRABCB1 | |
| SCHEMBL7029983 | 0.77 | MEN1 (0.41) | KDM4EHSD17B10HPGDTSHRKMT2A | |
| SCHEMBL28195586 | 0.77 | KDM4E (0.41) | KDM4EHSD17B10HPGDTSHRKMT2A | |
| SCHEMBL28864992 | 0.76 | ABCB1 (0.50) | KDM4EHSD17B10HPGDTSHRABCB1 | |
| SCHEMBL28448289 | 0.75 | HSD17B10 (0.46) | KDM4EHSD17B10HPGDTSHRABCB1 | |
| SCHEMBL8503692 | 0.75 | HSD17B10 (0.49) | KDM4EHSD17B10HPGDTSHRABCB1 | |
| SCHEMBL5790165 | 0.74 | HSD17B10 (0.57) | KDM4EHSD17B10HPGDTSHRABCB1 | |
| SCHEMBL19495269 | 0.73 | ABCB1 (0.51) | KDM4EHSD17B10HPGDTSHRABCB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109265369-A | A kind of preparation method of N- cyanoethyl-Phenhenzamine | 浙江汇翔化学工业有限公司 | 2019-01-25 | — | — | CN | disclosed |
| CN-105385185-B | Clean preparation method of weakly alkaline arylamine azo disperse dye | 大连理工大学 | 2017-12-05 | — | — | CN | disclosed |
| EP-1102744-A1 | NOVEL METHOD FOR PREPARING OPTICALLY ACTIVE ALPHA-AMINONITRILES | AVENTIS CROPSCIENCE S.A. (FR) | 2001-05-30 | — | — | EP | disclosed |
| WO-2000075104-A1 | NOVEL METHOD FOR PREPARING OPTICALLY ACTIVE ALPHA-AMINONITRILES | AVENTIS CROPSCIENCE SA (FR) | 2000-12-14 | — | — | WO | disclosed |