Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | MYC | P01106 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1160034 | 0.93 | GABRA1 (0.50) | GABRA1GABRB2CA2MYCALDH1A1 | |
| SCHEMBL1160003 | 0.84 | GABRA1 (0.41) | GABRA1GABRB2CA2MYCALDH1A1 | |
| SCHEMBL28215180 | 0.82 | GABRA1 (0.44) | GABRA1GABRB2CA2MYCALDH1A1 | |
| SCHEMBL9247985 | 0.78 | CA2 (0.46) | GABRA1GABRB2CA2ALDH1A1TSHR | |
| SCHEMBL14877302 | 0.78 | GABRA1 (0.60) | GABRA1GABRB2CA2MYCALDH1A1 | |
| SCHEMBL1160035 | 0.76 | GABRA1 (0.42) | GABRA1GABRB2CA2MYCALDH1A1 | |
| SCHEMBL31299806 | 0.75 | CA2 (0.37) | GABRA1GABRB2CA2ALDH1A1TSHR | |
| SCHEMBL28607703 | 0.74 | ALDH1A1 (0.57) | GABRA1GABRB2CA2ALDH1A1TSHR | |
| SCHEMBL29235924 | 0.73 | GABRA1 (0.50) | GABRA1GABRB2CA2MYCALDH1A1 | |
| SCHEMBL26499113 | 0.73 | GABRA1 (0.46) | GABRA1GABRB2CA2MYCALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8183311-B2 | Liquid phosphite composition derived from cresols | CHEMTURA CORPORATION (US) | 2012-05-22 | — | — | US | disclosed |
| WO-2011014211-A1 | LIQUID PHOSPHITE COMPOSITION DERIVED FROM META-CRESOLS | CHEMTURA CORPORATION (US) | 2011-02-03 | — | — | WO | disclosed |
| US-20100076125-A1 | LIQUID PHOSPHITE COMPOSITION DERIVED FROM CRESOLS | CHEMTURA CORPORATION (US) | 2010-03-25 | — | — | US | disclosed |