Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | NCF1 | P14598 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CHKA | P35790 | 1/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | IDE | P14735 | 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 | |
|---|---|---|---|---|
| SCHEMBL8870692 | 0.88 | PKM (0.47) | ALDH1A1CYP3A4CHRM1DRD3OPRK1 | |
| SCHEMBL8870772 | 0.86 | KMT2A (0.46) | ALDH1A1CYP3A4CHRM1DRD3OPRK1 | |
| SCHEMBL8870705 | 0.83 | PKM (0.49) | ALDH1A1CYP3A4CHRM1DRD3OPRK1 | |
| SCHEMBL8871972 | 0.80 | PKM (0.56) | ALDH1A1CYP3A4CHRM1DRD3OPRK1 | |
| SCHEMBL8871286 | 0.76 | PKM (0.52) | ALDH1A1CYP3A4CHRM1DRD3OPRK1 | |
| SCHEMBL8871837 | 0.74 | RXFP1 (0.58) | ALDH1A1PKMALOX15CASP1HSD17B10 | |
| SCHEMBL8871450 | 0.74 | PKM (0.47) | ALDH1A1CYP3A4CHRM1DRD3OPRK1 | |
| SCHEMBL8871447 | 0.74 | PKM (0.47) | ALDH1A1CYP3A4CHRM1DRD3OPRK1 | |
| SCHEMBL8871343 | 0.74 | CLK1 (0.48) | ALDH1A1CYP3A4CHRM1DRD3OPRK1 | |
| SCHEMBL8872345 | 0.71 | PKM (0.44) | ALDH1A1CYP3A4CHRM1DRD3OPRK1 |
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-5622914-A | APPLYING A PYRAZOLYL OR IMIDAZOLYL QUINOLINE DERIVATIVE; PLANT DISEASE CONTROL | NIHON BAYER AGROCHEM K.K. (JP) | 1997-04-22 | — | — | US | disclosed |
| EP-0703234-A1 | Microbicidal Quinoline Derivatives | NIHON BAYER AGROCHEM K.K. (JP) | 1996-03-27 | — | — | EP | disclosed |