Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 14/20 | 0.58 |
| ▸ | AKR1A1 | P14550 | 2/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25564343 | 1.00 | PDK2 (0.58) | PDK2AKR1A1AKR1B1CA1CA2 | |
| SCHEMBL27134882 | 0.82 | PDK2 (0.47) | PDK2AKR1A1AKR1B1KDM4EMEN1 | |
| SCHEMBL29618974 | 0.82 | PDK2 (0.47) | PDK2AKR1A1AKR1B1KDM4EMEN1 | |
| SCHEMBL15250328 | 0.81 | PDK2 (0.41) | PDK2AKR1A1AKR1B1KDM4EMEN1 | |
| SCHEMBL25564319 | 0.78 | PDK2 (0.58) | PDK2AKR1A1AKR1B1CA1CA2 | |
| SCHEMBL21928624 | 0.78 | PDK2 (0.42) | PDK2AKR1A1AKR1B1CA1CA2 | |
| SCHEMBL27324420 | 0.78 | PDK2 (0.56) | PDK2AKR1A1AKR1B1CA1CA2 | |
| SCHEMBL15848159 | 0.78 | KDM4E (0.47) | PDK2AKR1A1AKR1B1KDM4EMEN1 | |
| SCHEMBL29355276 | 0.76 | KMT2A (0.56) | PDK2KDM4EMEN1LMNAMAPT | |
| SCHEMBL44942 | 0.76 | KMT2A (0.56) | PDK2KDM4EMEN1LMNAMAPT |
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-2024033282-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2024-02-15 | — | — | WO | disclosed |