Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 5/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | MGLL | Q99685 | 2/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | G6PD | P11413 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23812466 | 0.73 | TLR7 (0.49) | TLR7ADORA2BTLR8ALDH1A1HPGD | |
| SCHEMBL5397038 | 0.72 | POLB (0.37) | ADORA2BALDH1A1CYP3A4HSD17B10MEN1 | |
| SCHEMBL16774865 | 0.70 | TLR8 (0.39) | ADORA2BTLR8PTGS1PTGS2MGLL | |
| SCHEMBL7248981 | 0.68 | MAPT (0.35) | TLR7ADORA2BALDH1A1TSHR | |
| Sulfuric Acid SCHEMBL29817313 | 0.68 | ALDH1A1 (0.39) | TLR7ADORA2BALDH1A1TP53CYP3A4 | |
| SCHEMBL6816040 | 0.67 | ADORA2B (0.36) | ADORA2BTLR8ALDH1A1KDR | |
| SCHEMBL5021145 | 0.66 | GGPS1 (0.47) | PTGS1PTGS2MGLLFAAHALDH1A1 | |
| SCHEMBL13073400 | 0.66 | GGPS1 (0.47) | PTGS1PTGS2MGLLFAAHALDH1A1 | |
| SCHEMBL9926297 | 0.66 | GGPS1 (0.47) | PTGS1PTGS2MGLLFAAHALDH1A1 | |
| SCHEMBL5021140 | 0.66 | GGPS1 (0.47) | PTGS1PTGS2MGLLFAAHALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4593105-A | REACTING ARYLDIAMINE WITH THIOCYANATE | UNIROYAL CHEMICAL COMPANY, INC. (US) | 1986-06-03 | — | — | US | disclosed |