Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.52 |
| ▸ | CTSD | P07339 | 1/20 | 0.52 |
| ▸ | BACE1 | P56817 | 1/20 | 0.52 |
| ▸ | FABP6 | P51161 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 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 |
| ▸ | MASP2 | O00187 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5679139 | 0.82 | ALDH1A1 (0.50) | BACE1FABP6ALDH1A1JAK3MAPK14 | |
| SCHEMBL5678732 | 0.82 | JAK2 (0.55) | TRPA1BACE1FABP6ALDH1A1JAK3 | |
| SCHEMBL5682985 | 0.82 | BACE1 (0.52) | TRPA1BACE1ALDH1A1MAPK14MASP2 | |
| SCHEMBL30494494 | 0.81 | ABL1 (0.52) | FABP6ALDH1A1MASP2MEN1NUDT1 | |
| SCHEMBL5679161 | 0.81 | DHFR (0.56) | ALDH1A1MASP2MEN1NUDT1KMT2A | |
| SCHEMBL26463431 | 0.81 | ABL1 (0.52) | FABP6ALDH1A1MASP2MEN1NUDT1 | |
| SCHEMBL3827667 | 0.79 | ALDH1A1 (0.58) | BACE1FABP6ALDH1A1MAPK14MASP2 | |
| Hydrochloric Acid SCHEMBL30033738 | 0.78 | HTR7 (0.48) | TRPA1CTSDBACE1ALDH1A1LCK | |
| Hydrochloric Acid SCHEMBL27136368 | 0.78 | HTR7 (0.48) | TRPA1CTSDBACE1ALDH1A1LCK | |
| SCHEMBL5679426 | 0.78 | FABP6 (0.53) | BACE1FABP6ALDH1A1MASP2MEN1 |
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-1620413-A2 | COMPOUNDS, COMPOSITIONS, AND METHODS | Cytokinetics, Inc. (US) | 2006-02-01 | — | — | EP | disclosed |
| WO-2004098494-A2 | COMPOUNDS, COMPOSITIONS, AND METHODS | CYTOKINETICS, INC. (US) | 2004-11-18 | — | — | WO | disclosed |