Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ELANE | P08246 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 4/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD3 | P35462 | 2/20 | 0.32 |
| ▸ | NRP1 | O14786 | 1/20 | 0.31 |
| ▸ | KDM2B | Q8NHM5 | 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 | |
|---|---|---|---|---|
| SCHEMBL24523725 | 0.73 | IMPDH2 (0.38) | ALDH1A1KDM4EMAOAMAOB | |
| SCHEMBL24523738 | 0.73 | TRPV4 (0.38) | ALDH1A1KDM4EMAOAMAOB | |
| SCHEMBL29391392 | 0.73 | MAOA (0.43) | PDCD1CD274PTGDR2ALDH1A1KDM4E | |
| SCHEMBL24523964 | 0.70 | PNMT (0.31) | ALDH1A1ELANEKDM4E | |
| SCHEMBL24523737 | 0.70 | IMPDH2 (0.35) | ALDH1A1KDM4EMAOAAR | |
| SCHEMBL24523907 | 0.70 | MAOA (0.40) | ALDH1A1KDM4EMAOAMAOBNPSR1 | |
| SCHEMBL24523744 | 0.70 | AR (0.44) | AR | |
| SCHEMBL24523768 | 0.69 | MAOA (0.38) | ALDH1A1KDM4EMAOAMAOBNPSR1 | |
| SCHEMBL25498943 | 0.69 | AR (0.47) | DYRK1AAR | |
| SCHEMBL27718550 | 0.69 | PTGDR2 (0.52) | PTGDR2MAOAMAOBDRD2DRD3 |
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 |