Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.37 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MYB | P10242 | 1/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.32 |
| ▸ | CBX7 | O95931 | 1/20 | 0.32 |
| ▸ | CDYL2 | Q8N8U2 | 1/20 | 0.32 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24523825 | 0.86 | TNKS (0.37) | CA1CA2KDM4EALDH1A1MEN1 | |
| SCHEMBL24523784 | 0.85 | ENPP3 (0.35) | CA1CA2ENPP3CDY1; CDY1B | |
| SCHEMBL24523828 | 0.85 | CDY1; CDY1B (0.36) | CA1CA2KDM4EALDH1A1ENPP3 | |
| SCHEMBL24524318 | 0.83 | KMO (0.30) | — | |
| SCHEMBL24523833 | 0.82 | TNKS (0.39) | KDM4EALDH1A1MEN1CYP3A4GAA | |
| SCHEMBL24523767 | 0.82 | CA1 (0.46) | CA1CA2KDM4EALDH1A1CYP1A2 | |
| SCHEMBL24523806 | 0.82 | ENPP3 (0.32) | ENPP3 | |
| SCHEMBL24523718 | 0.79 | ACLY (0.34) | ALDH1A1ENPP3PRKDC | |
| SCHEMBL24523749 | 0.76 | ENPP3 (0.39) | CA1CA2KDM4EALDH1A1GAA | |
| SCHEMBL24523819 | 0.75 | ENPP3 (0.35) | CA1CA2ENPP3 |
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 |