Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 6/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9936511 | 1.00 | PDK2 (0.56) | PDK2MAPTLMNAGPR55POLB | |
| SCHEMBL30956355 | 0.89 | PDK2 (0.46) | PDK2ESR2ALOX5ESR1OPRM1 | |
| SCHEMBL2123476 | 0.89 | PDK2 (0.46) | PDK2ESR2ALOX5ESR1OPRM1 | |
| SCHEMBL9937344 | 0.88 | PDK2 (0.61) | PDK2MAPTLMNAGPR55POLB | |
| SCHEMBL30559652 | 0.88 | PDK2 (0.61) | PDK2MAPTLMNAGPR55POLB | |
| SCHEMBL13700678 | 0.85 | PDK2 (0.60) | PDK2ESR2ESR1MEN1KMT2A | |
| SCHEMBL9604555 | 0.84 | ESR2 (0.53) | PDK2ESR2ESR1CYP2C19CYP3A4 | |
| SCHEMBL21383381 | 0.83 | HSD17B1 (0.50) | PDK2ESR2ESR1CYP2C19CYP3A4 | |
| SCHEMBL16022361 | 0.82 | PDK2 (0.44) | PDK2ESR2ALOX5ESR1MEN1 | |
| SCHEMBL17789542 | 0.81 | PDK2 (0.43) | PDK2MAPTLMNAGPR55POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-110741002-B | Heterocyclic compound and organic light-emitting device comprising same | 株式会社LG化学 | 2023-12-05 | — | — | CN | disclosed |
| CN-110291077-B | Novel heterocyclic compound and organic light emitting device comprising the same | 株式会社LG化学 | 2022-05-17 | — | — | CN | disclosed |