Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 5/20 | 0.41 |
| ▸ | CA12 | O43570 | 4/20 | 0.41 |
| ▸ | CA9 | Q16790 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.38 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.38 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| Pentane SCHEMBL27743488 | 0.87 | ALDH1A1 (0.75) | TSHRALDH1A1TDP1KDM4ECA2 | |
| Hexane SCHEMBL27260332 | 0.87 | ALDH1A1 (0.75) | TSHRALDH1A1TDP1KDM4ECA2 | |
| Heptane SCHEMBL27259929 | 0.85 | ALDH1A1 (0.72) | TSHRALDH1A1TDP1CA2HSD17B10 | |
| Butane SCHEMBL10945777 | 0.83 | ALDH1A1 (0.82) | TSHRALDH1A1TDP1KDM4ECA2 | |
| Propane SCHEMBL2158316 | 0.81 | ALDH1A1 (0.86) | TSHRALDH1A1TDP1KDM4ECA2 | |
| Alcohol SCHEMBL8858986 | 0.79 | ALDH1A1 (0.82) | TSHRALDH1A1TDP1KDM4ECA2 | |
| SCHEMBL22729938 | 0.79 | ALDH1A1 (1.00) | TSHRALDH1A1TDP1KDM4ECA2 | |
| SCHEMBL51803 | 0.79 | ALDH1A1 (1.00) | TSHRALDH1A1TDP1KDM4ECA2 | |
| SCHEMBL29358279 | 0.79 | ALDH1A1 (1.00) | TSHRALDH1A1TDP1KDM4ECA2 | |
| Dimethylamine SCHEMBL29017905 | 0.77 | ALDH1A1 (0.86) | TSHRALDH1A1TDP1KDM4ESIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1040014-C | Environmental etch resistant, one-component, coating composition, method of coating therewith, and coating obtained therefrom | BASF AG (US) | 1998-09-30 | — | — | CN | disclosed |
| CN-1081702-A | The one-component coating compositions of environmental corrosion resisting, coating method reach the coating of gained thus | BASF CORP (US) | 1994-02-09 | — | — | CN | disclosed |