Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.48 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.48 |
| ▸ | FYN | P06241 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | AHR | P35869 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | CASP1 | P29466 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4630262 | 0.83 | ALDH1A1 (0.50) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL17183137 | 0.83 | HSD17B10 (0.50) | CYP1A2ERBB2FYNMAOAACHE | |
| Sulfuric Acid SCHEMBL7994836 | 0.80 | ERBB2 (0.43) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL2314306 | 0.79 | CYP1A2 (0.46) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL598696 | 0.79 | CYP1A2 (0.69) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL598643 | 0.78 | TRPM4 (0.46) | CYP1A2ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL17183186 | 0.77 | CYP1A2 (0.44) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL7773085 | 0.77 | CYP1A2 (0.67) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL10484179 | 0.77 | HPRT1 (0.56) | CYP1A2ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL5664790 | 0.75 | CYP1A2 (0.55) | CYP1A2ERBB2FYNMAOAACHE |
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-1163518-A2 | ELISA KIT FOR THE DETERMINATION OF METABOLIC PHENOTYPES | Leyland-Jones, Brian (CA) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000055624-A2 | ELISA KIT FOR THE DETERMINATION OF METABOLIC PHENOTYPES | LEYLAND JONES BRIAN (CA) | 2000-09-21 | — | — | WO | disclosed |