Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.53 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 10/20 | 0.49 |
| ▸ | NPC1 | O15118 | 8/20 | 0.49 |
| ▸ | GAA | P10253 | 6/20 | 0.49 |
| ▸ | MAPT | P10636 | 6/20 | 0.48 |
| ▸ | SRC | P12931 | 1/20 | 0.47 |
| ▸ | BRAF | P15056 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL23458488 | 1.00 | HTT (0.53) | HTTCDK5CDK5R1CYP1A2CYP3A4 | |
| SCHEMBL29033683 | 0.88 | CYP1A2 (0.63) | HTTCYP1A2CYP3A4RAB9ANPC1 | |
| SCHEMBL30498957 | 0.88 | CYP1A2 (0.63) | HTTCYP1A2CYP3A4RAB9ANPC1 | |
| SCHEMBL28724437 | 0.79 | RAB9A (0.71) | CYP1A2CYP3A4POLBRAB9ANPC1 | |
| SCHEMBL28724436 | 0.79 | RAB9A (0.71) | CYP1A2CYP3A4POLBRAB9ANPC1 | |
| SCHEMBL30197728 | 0.77 | SRC (0.53) | HTTCDK5CDK5R1CYP1A2POLB | |
| SCHEMBL17560803 | 0.71 | RAB9A (0.55) | HTTCDK5CDK5R1POLBRAB9A | |
| SCHEMBL17560809 | 0.71 | RAB9A (0.55) | HTTCDK5CDK5R1POLBRAB9A | |
| SCHEMBL28663162 | 0.71 | CTH (0.45) | HTTCYP1A2CYP3A4POLBRAB9A | |
| SCHEMBL8977620 | 0.70 | MAPT (0.75) | HTTCDK5CDK5R1CYP1A2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021110890-A1 | PYRIDINIUM DERIVATIVES AS HERBICIDES | SYNGENTA CROP PROTECTION AG (CH) | 2021-06-10 | — | — | WO | disclosed |