Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.72 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.72 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.72 |
| ▸ | TSHR | P16473 | 4/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.72 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.72 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.72 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.72 |
| ▸ | LMNA | P02545 | 2/20 | 0.72 |
| ▸ | THRB | P10828 | 1/20 | 0.72 |
| ▸ | RECQL | P46063 | 1/20 | 0.72 |
| ▸ | ATM | Q13315 | 1/20 | 0.72 |
| ▸ | HTT | P42858 | 1/20 | 0.72 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | KCNH3 | Q9ULD8 | 4/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1029396 | 0.87 | ALDH1A1 (0.52) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 | |
| SCHEMBL38820 | 0.85 | ALDH1A1 (1.00) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 | |
| SCHEMBL655572 | 0.85 | ALDH1A1 (1.00) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 | |
| Hydrogen Sulfide SCHEMBL8467082 | 0.83 | ALDH1A1 (0.95) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 | |
| N,N'-Diphenyl-P-Phenylenediamine SCHEMBL10454790 | 0.83 | ALDH1A1 (0.95) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 | |
| SCHEMBL8467092 | 0.83 | ALDH1A1 (0.95) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 | |
| N,N'-Diphenyl-P-Phenylenediamine SCHEMBL10454791 | 0.83 | ALDH1A1 (0.95) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 | |
| SCHEMBL10866233 | 0.83 | ALDH1A1 (0.95) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 | |
| Hydrochloric Acid SCHEMBL716679 | 0.83 | ALDH1A1 (0.95) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 | |
| SCHEMBL6681258 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HSD17B10TDP1TSHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7125475-B2 | Nitrosophenols and C-nitrosoanilines as polymerization inhibitors | CROMPTON CORPORATION (US) | 2006-10-24 | — | — | US | claimed |