Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.57 |
| ▸ | BACE1 | P56817 | 1/20 | 0.57 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.53 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.50 |
| ▸ | LCK | P06239 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 1/20 | 0.50 |
| ▸ | JAK3 | P52333 | 1/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3155647 | 0.94 | CTSD (0.59) | CTSDBACE1TRPA1GSTP1LCK | |
| SCHEMBL14417256 | 0.82 | ESR2 (0.73) | CTSDBACE1TRPA1ESR2ESR1 | |
| SCHEMBL29274331 | 0.82 | GSTP1 (0.64) | GSTP1ESR2ESR1HDAC4HDAC2 | |
| SCHEMBL28841094 | 0.82 | CYP11B2 (0.59) | CTSDBACE1TRPA1GSTP1ABL1 | |
| SCHEMBL19440078 | 0.81 | CYP11B2 (0.62) | CTSDBACE1TRPA1GSTP1ABL1 | |
| SCHEMBL28941804 | 0.80 | CYP1A2 (0.57) | CTSDBACE1TRPA1LCKKDR | |
| SCHEMBL30177593 | 0.80 | CYP1A2 (0.57) | CTSDBACE1TRPA1LCKKDR | |
| SCHEMBL2557207 | 0.80 | GSTP1 (0.52) | CTSDBACE1TRPA1GSTP1LCK | |
| SCHEMBL26154428 | 0.80 | CTSD (0.54) | CTSDBACE1TRPA1LCKKDR | |
| SCHEMBL5255693 | 0.79 | TRPA1 (0.57) | CTSDBACE1TRPA1LCKKDR |
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-4478753-A | HALOMETHYLATION, FORMYLATION, DECYANATION, AND DEHYDROGENATION | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 1984-10-23 | — | — | US | disclosed |
| EP-0076639-A1 | Production of 11,11,12,12-Tetracyano-9,10-anthraquinodimethane and derivatives thereof | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 1983-04-13 | — | — | EP | disclosed |