Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | KMO | O15229 | 1/20 | 0.38 |
| ▸ | FABP4 | P15090 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1101352 | 0.86 | ASPH (0.37) | LDHAALDH1A1HPGDAKR1C3AKR1C2 | |
| SCHEMBL29702020 | 0.82 | ALDH1A1 (0.43) | LDHAPLK1ALDH1A1HPGDAKR1C3 | |
| SCHEMBL28696539 | 0.81 | PTPN1 (0.46) | AKR1C3AKR1C2PTPN1BACE1FABP4 | |
| SCHEMBL28636307 | 0.78 | ALDH1A1 (0.45) | LDHAPLK1ALDH1A1HPGDAKR1C3 | |
| SCHEMBL28688436 | 0.77 | DHODH (0.43) | LDHAPLK1AKR1C3AKR1C2 | |
| SCHEMBL6067691 | 0.75 | KIF11 (0.39) | LDHAPLK1ALDH1A1HPGDKDM4E | |
| SCHEMBL28672486 | 0.75 | AKR1C3 (0.49) | AKR1C3AKR1C2KMOHDAC6 | |
| SCHEMBL344492 | 0.75 | ALDH1A1 (0.49) | PLK1ALDH1A1HPGDKMOFABP4 | |
| SCHEMBL3193261 | 0.74 | BACE1 (0.38) | LDHAPLK1ALDH1A1HPGDAKR1C3 | |
| SCHEMBL9185655 | 0.73 | ASPH (0.39) | LDHAALDH1A1HPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-113943287-A | Polycyclic aromatic compound and application thereof in electroluminescent device | 清华大学 | 2022-01-18 | — | — | CN | disclosed |