Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.67 |
| ▸ | CA9 | Q16790 | 6/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.67 |
| ▸ | CA1 | P00915 | 3/20 | 0.67 |
| ▸ | CA2 | P00918 | 2/20 | 0.67 |
| ▸ | CA3 | P07451 | 2/20 | 0.67 |
| ▸ | CA4 | P22748 | 2/20 | 0.67 |
| ▸ | CA5A | P35218 | 2/20 | 0.67 |
| ▸ | CA7 | P43166 | 2/20 | 0.67 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.67 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.67 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | CA6 | P23280 | 1/20 | 0.67 |
| ▸ | SOST | Q9BQB4 | 1/20 | 0.67 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Coumarin SCHEMBL23929067 | 0.90 | CA12 (0.77) | CA12CA9TDP1CA1CA2 | |
| Benzophenone SCHEMBL27755446 | 0.86 | CA12 (0.71) | CA12CA9TDP1CA1CA2 | |
| Coumarin SCHEMBL1090505 | 0.86 | CA12 (0.83) | CA12CA9TDP1CA1CA2 | |
| Coumarin SCHEMBL25431834 | 0.86 | CA12 (0.91) | CA12CA9TDP1CA1CA2 | |
| Umbelliferone SCHEMBL17063687 | 0.84 | CA12 (0.68) | CA12CA9TDP1CA1CA2 | |
| Coumarin SCHEMBL28089700 | 0.84 | F7 (0.59) | CA12CA9TDP1CA1CA2 | |
| Coumarin SCHEMBL28423147 | 0.84 | CA12 (0.95) | CA12CA9TDP1CA1CA2 | |
| Coumarin SCHEMBL19183240 | 0.84 | CA12 (0.95) | CA12CA9TDP1CA1CA2 | |
| SCHEMBL7358531 | 0.84 | CA12 (0.95) | CA12CA9TDP1CA1CA2 | |
| Coumarin SCHEMBL29078087 | 0.82 | CA12 (0.77) | CA12CA9TDP1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013029075-A1 | MEANS AND METHOD FOR ALKYLATION | TECHNISCHE UNIVERSITÄT GRAZ (AT) | 2013-03-07 | — | — | WO | disclosed |