Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 7/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | S100A4 | P26447 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 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 | |
|---|---|---|---|---|
| SCHEMBL16810775 | 0.89 | PDK2 (0.44) | PDK2HSD11B1CA1CA2CA7 | |
| SCHEMBL21296008 | 0.85 | PDK2 (0.49) | PDK2HSD11B1CA1CA2CA7 | |
| SCHEMBL30517278 | 0.85 | PDK2 (0.49) | PDK2HSD11B1CA1CA2CA7 | |
| SCHEMBL19299505 | 0.85 | PDK2 (0.50) | PDK2HSD11B1DPP4CYP2A6S100A4 | |
| SCHEMBL19298906 | 0.84 | PDK2 (0.42) | PDK2 | |
| SCHEMBL29484645 | 0.83 | PDK2 (0.56) | PDK2CA1CA2CA7CA9 | |
| SCHEMBL10053123 | 0.83 | PDK2 (0.56) | PDK2CA1CA2CA7CA9 | |
| SCHEMBL19001983 | 0.83 | PDK2 (0.46) | PDK2DPP4CA1CA2CA7 | |
| SCHEMBL18160253 | 0.82 | PDK2 (0.49) | PDK2CA1CA2CA7CA9 | |
| SCHEMBL19299404 | 0.81 | PDK2 (0.41) | PDK2MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3419960-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2020-07-01 | — | — | EP | disclosed |
| WO-2017144150-A2 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2017-08-31 | — | — | WO | disclosed |