Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP3 | O14638 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | BRD4 | O60885 | 2/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | PARP14 | Q460N5 | 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 | |
|---|---|---|---|---|
| SCHEMBL24523830 | 0.89 | ENPP3 (0.37) | ENPP3CA1CA2BRD4CYP19A1 | |
| SCHEMBL23823661 | 0.85 | KDM4E (0.39) | ALDH1A1DUSP3KDM4EMEN1POLB | |
| SCHEMBL29729688 | 0.85 | ENPP3 (0.43) | ENPP3ALDH1A1DUSP3CA1CA2 | |
| SCHEMBL24523713 | 0.85 | KDM4E (0.39) | ENPP3ALDH1A1PTGDR2KDM4EMAPT | |
| SCHEMBL24523809 | 0.84 | CA1 (0.42) | ENPP3ALDH1A1CA1CA2CYP19A1 | |
| SCHEMBL21718084 | 0.84 | KDM4E (0.36) | ALDH1A1DUSP3KDM4EMEN1POLB | |
| SCHEMBL24523808 | 0.84 | CA1 (0.42) | ENPP3CA1CA2 | |
| SCHEMBL24524203 | 0.82 | TDP2 (0.38) | ENPP3DUSP3CYP19A1KDM4E | |
| SCHEMBL24523714 | 0.82 | ENPP3 (0.33) | ENPP3BRD4CREBBP | |
| SCHEMBL24523765 | 0.82 | PTGDR2 (0.40) | ENPP3CYP19A1PTGDR2MEN1KMT2A |
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 |