Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP3 | O14638 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | G6PD | P11413 | 2/20 | 0.33 |
| ▸ | CDC7 | O00311 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 2/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP2 | O95551 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24601758 | 0.88 | CA1 (0.40) | ENPP3CA1CA2G6PDALDH1A1 | |
| SCHEMBL24523847 | 0.88 | CA1 (0.40) | ENPP3CA1CA2G6PDALDH1A1 | |
| SCHEMBL24523749 | 0.87 | ENPP3 (0.39) | ENPP3CA1CA2G6PDALDH1A1 | |
| SCHEMBL24523879 | 0.82 | CA1 (0.40) | ENPP3CA1CA2G6PDALDH1A1 | |
| SCHEMBL24601626 | 0.80 | ENPP3 (0.35) | ENPP3CA1CA2G6PDALDH1A1 | |
| SCHEMBL24523773 | 0.79 | CA1 (0.40) | ENPP3CA1CA2CDC7CDK2 | |
| SCHEMBL24741396 | 0.79 | CA1 (0.46) | CA1CA2G6PDALDH1A1KDM4E | |
| SCHEMBL24601749 | 0.78 | CA1 (0.40) | ENPP3CA1CA2G6PDALDH1A1 | |
| SCHEMBL29729688 | 0.78 | ENPP3 (0.43) | ENPP3CA1CA2G6PDCDC7 | |
| SCHEMBL24523846 | 0.78 | AR (0.37) | ENPP3CA1CA2G6PDCDC7 |
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-2022129116-A1 | INDOLO[3.2.1-JK]CARBAZOLE-6-CARBONITRILE DERIVATIVES AS BLUE FLUORESCENT EMITTERS FOR USE IN OLEDS | MERCK PATENT GMBH (DE) | 2022-06-23 | — | — | WO | disclosed |