Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | F2R | P25116 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ELOVL1 | Q9BW60 | 2/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL22908189 | 0.87 | NPC1 (0.53) | NPC1SMN1; SMN2ALDH1A1LMNARAB9A | |
| SCHEMBL15640077 | 0.81 | NPC1 (0.51) | NPC1SMN1; SMN2ALDH1A1LMNARAB9A | |
| SCHEMBL15639835 | 0.76 | ALDH1A1 (0.45) | NPC1SMN1; SMN2ALDH1A1LMNARAB9A | |
| SCHEMBL29571859 | 0.76 | ALDH1A1 (0.45) | NPC1SMN1; SMN2ALDH1A1LMNARAB9A | |
| SCHEMBL15639397 | 0.75 | NPC1 (0.53) | NPC1SMN1; SMN2ALDH1A1LMNARAB9A | |
| SCHEMBL29572327 | 0.75 | NPC1 (0.53) | NPC1SMN1; SMN2ALDH1A1LMNARAB9A | |
| SCHEMBL759251 | 0.69 | EGFR (0.62) | NPC1SMN1; SMN2ALDH1A1LMNARAB9A | |
| SCHEMBL755797 | 0.68 | EGFR (0.63) | NPC1SMN1; SMN2ALDH1A1LMNARAB9A | |
| SCHEMBL15638970 | 0.68 | SMN1; SMN2 (0.46) | NPC1SMN1; SMN2ALDH1A1LMNARAB9A | |
| SCHEMBL2726850 | 0.68 | MEN1 (0.65) | NPC1SMN1; SMN2RAB9AL3MBTL1GAA |
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-2903440-B1 | HETEROCYCLIC COMPOUNDS AS PEST CONTROLLING AGENTS | BAYER CROPSCIENCE AG (DE) | 2017-09-06 | — | — | EP | disclosed |