Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.35 |
| ▸ | IDH1 | O75874 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.33 |
| ▸ | USP14 | P54578 | 1/20 | 0.33 |
| ▸ | ITK | Q08881 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | G6PD | P11413 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24523831 | 0.86 | ENPP3 (0.37) | CHEK1ENPP3G6PD | |
| SCHEMBL16621665 | 0.83 | PTGER4 (0.40) | ALDH1A1CYP2A6ENPP3 | |
| SCHEMBL24523755 | 0.82 | KIF11 (0.42) | CHEK1ENPP3 | |
| SCHEMBL24523743 | 0.81 | RXFP1 (0.37) | ALDH1A1CYP2A6CHEK1ENPP3AR | |
| SCHEMBL20857943 | 0.79 | ENPP3 (0.41) | ALDH1A1ENPP3ARG6PD | |
| SCHEMBL24523819 | 0.79 | ENPP3 (0.35) | CHEK1ENPP3G6PD | |
| SCHEMBL24523719 | 0.79 | MEN1 (0.39) | ENPP3G6PD | |
| SCHEMBL24523732 | 0.78 | CHEK1 (0.36) | ALDH1A1CYP2A6CHEK1ENPP3USP14 | |
| SCHEMBL29729688 | 0.78 | ENPP3 (0.43) | ALDH1A1ENPP3ARG6PD | |
| SCHEMBL24523722 | 0.78 | MEN1 (0.38) | ENPP3G6PD |
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 |