Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | SLC10A2 | Q12908 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 2/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.38 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.36 |
| ▸ | BUB1 | O43683 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.35 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11904283 | 0.79 | CA12 (0.43) | CA12CA1CA9SLC10A2BRD4 | |
| SCHEMBL29921889 | 0.76 | CA12 (0.47) | CA12CA1CA9BRD4CREBBP | |
| SCHEMBL12470984 | 0.75 | CA12 (0.42) | CA12CA1CA9BRD4CREBBP | |
| SCHEMBL11904033 | 0.75 | MAPT (0.53) | CA12CA1CA9SIRT2SIRT1 | |
| SCHEMBL29921932 | 0.73 | KDM4E (0.53) | CA12CA1CA9SIRT2SIRT1 | |
| SCHEMBL15022432 | 0.72 | MAPT (0.52) | CA12CA1CA9BRD4CREBBP | |
| SCHEMBL7235169 | 0.69 | BAZ2B (0.52) | CA12CA1CA9ACHEBACE1 | |
| SCHEMBL20809725 | 0.69 | BAZ2B (0.55) | CA12CA1CA9NR1I3 | |
| SCHEMBL30781540 | 0.69 | BAZ2B (0.55) | CA12CA1CA9NR1I3 | |
| SCHEMBL4314672 | 0.69 | CA12 (0.49) | CA12CA1CA9PSMB8PRKDC |
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-2012107262-A1 | DIHYDROBENZOPYRAN, THIOCHROMAN, TETRAHYDROQUINOLEINE AND TETRAHYDRONAPHTALENE DERIVATIVES AND THEIR USE IN ANTICANCER THERAPY | UNIVERSITE DE LIEGE (BE) | 2012-08-16 | — | — | WO | disclosed |