Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10493670 | 0.81 | AHR (0.46) | AHRTSHRTP53IDO1TDO2 | |
| SCHEMBL28674464 | 0.77 | AHR (0.42) | AHRTSHRTP53IDO1TDO2 | |
| SCHEMBL1573475 | 0.77 | AHR (0.52) | AHRTSHRTP53IDO1TDO2 | |
| SCHEMBL28326049 | 0.77 | AHR (0.52) | AHRTSHRTP53IDO1TDO2 | |
| SCHEMBL10867874 | 0.73 | AHR (0.48) | AHRTP53IDO1TDO2IDO2 | |
| SCHEMBL11311703 | 0.73 | AHR (0.48) | AHRTSHRTP53IDO1TDO2 | |
| SCHEMBL9250303 | 0.72 | TSHR (0.64) | TSHRTP53IDO1TDO2LMNA | |
| SCHEMBL20076586 | 0.71 | SLC6A4 (0.42) | AHRTSHRTP53IDO1TDO2 | |
| SCHEMBL10680633 | 0.70 | TRPV4 (0.55) | AHRTSHRTP53IDO1TDO2 | |
| SCHEMBL12715529 | 0.70 | AHR (0.50) | AHRTSHRTP53IDO1TDO2 |
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-4156602-A | 1-(1-Chloropropyl)-2,4,6-triisopropylbenzene and its use to control weeds | PPG INDUSTRIES, INC. (US) | 1979-05-29 | — | — | US | disclosed |