Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | SCN4A | P35499 | 1/20 | 0.36 |
| ▸ | MC3R | P41968 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4050171 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TRPA1CYP3A4GABRA1GABRB2 | |
| SCHEMBL9417107 | 0.81 | ALDH1A1 (0.40) | ALDH1A1TRPA1CYP3A4KDM4EMAPT | |
| SCHEMBL5680576 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TRPA1CYP3A4GABRA1GABRB2 | |
| SCHEMBL4300630 | 0.78 | TRPA1 (0.39) | ALDH1A1TRPA1CYP3A4MAPTLMNA | |
| SCHEMBL8217171 | 0.78 | ALDH1A1 (0.35) | ALDH1A1TRPA1CYP3A4KDM4EHSD17B10 | |
| SCHEMBL12773871 | 0.78 | ALDH1A1 (0.38) | ALDH1A1TRPA1CYP3A4GABRA1GABRB2 | |
| SCHEMBL328909 | 0.78 | CYP3A4 (0.46) | ALDH1A1CYP3A4KDM4EMAPTRAB9A | |
| SCHEMBL29520654 | 0.78 | CYP3A4 (0.46) | ALDH1A1CYP3A4KDM4EMAPTRAB9A | |
| Hydrochloric Acid SCHEMBL10630985 | 0.77 | ALDH1A1 (0.38) | ALDH1A1TRPA1CYP3A4MAPTLMNA | |
| SCHEMBL21065758 | 0.76 | CYP3A4 (0.44) | ALDH1A1CYP3A4KDM4EMAPTRAB9A |
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-RE33635-E | Enzymatic assay method | TOYO JOZO KABUSHIKI KAISHA (JP) | 1991-07-09 | — | — | US | disclosed |
| US-4681841-A | CONSUMING OXYGEN OR GENERATING A PIGMENT; MEASUREMENT BY AN OXYGEN ELECTRODE OR COLORIMETRIC ASSAY | TOYO JOZO KABUSHIKI KAISHA (JP) | 1987-07-21 | — | — | US | disclosed |