Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GRM5 | P41594 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | VCP | P55072 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14114058 | 0.87 | ALDH1A1 (0.41) | CA9CA12CA1HSD17B10APEX1 | |
| SCHEMBL13132630 | 0.82 | CA1 (0.50) | CA9CA12CA1NPSR1ALDH1A1 | |
| SCHEMBL13132794 | 0.82 | CA1 (0.50) | CA9CA12CA1NPSR1ALDH1A1 | |
| SCHEMBL10000440 | 0.81 | POLB (0.44) | HSD17B10APEX1ALDH1A1GRM5MEN1 | |
| SCHEMBL20716046 | 0.80 | ALDH1A1 (0.55) | CA9CA12CA1HSD17B10ALDH1A1 | |
| SCHEMBL10000527 | 0.80 | MEN1 (0.46) | CA9CA12CA1HSD17B10NPSR1 | |
| SCHEMBL9967357 | 0.80 | CA9 (0.51) | CA9CA12CA1HSD17B10NPSR1 | |
| SCHEMBL13900300 | 0.79 | CA9 (0.66) | CA9CA12CA1APEX1NPSR1 | |
| SCHEMBL10000450 | 0.79 | MAPK1 (0.53) | CA9CA12CA1ALDH1A1GRM5 | |
| SCHEMBL29637688 | 0.79 | CA9 (0.66) | CA9CA12CA1APEX1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8289833-B2 | Method for high density data storage and imaging | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2012-10-16 | — | — | US | disclosed |
| US-20120033539-A1 | METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2012-02-09 | — | — | US | disclosed |