Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | GAA | P10253 | 5/20 | 0.41 |
| ▸ | GLA | P06280 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CFTR | P13569 | 2/20 | 0.40 |
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL14956928 | 0.87 | ALDH1A1 (0.47) | KDM4EALDH1A1GAAGLAHSD17B10 | |
| SCHEMBL27473142 | 0.86 | GABRA1 (0.40) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL14967079 | 0.81 | ALDH1A1 (0.45) | KDM4EALDH1A1GAAGLAHSD17B10 | |
| SCHEMBL13853239 | 0.79 | CYP1A2 (0.54) | KDM4EALDH1A1HSD17B10MAPTTSHR | |
| SCHEMBL5264558 | 0.78 | CYP1A2 (0.53) | KDM4EALDH1A1GAAHSD17B10HPGD | |
| SCHEMBL27907009 | 0.78 | KDM4E (0.44) | KDM4EALDH1A1GAAGLAHSD17B10 | |
| SCHEMBL27622981 | 0.77 | KDM4E (0.47) | KDM4EALDH1A1GAAGLAHSD17B10 | |
| SCHEMBL20306004 | 0.75 | ALDH1A1 (0.49) | KDM4EALDH1A1GAAGLAHSD17B10 | |
| SCHEMBL28251522 | 0.75 | CA12 (0.35) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL27459666 | 0.74 | ALDH1A1 (0.49) | KDM4EALDH1A1HSD17B10HPGDMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117658893-A | Method for carrying out cis-trans selective hydrogenation on 2, 5-substituted pyridine derivative by utilizing micro-packed bed | 南京药石科技股份有限公司 | 2024-03-08 | — | — | CN | disclosed |
| CN-1210267-C | 2-hydroxy-mutilin carbamate derivatives for antibacterial use | SMITHKLINE BEECHAM PLC (GB) | 2005-07-13 | — | — | CN | disclosed |
| CN-1427827-A | 2-Hydroxy-mutilin carbamate derivatives for antibacterial use | SMITHKLINE BEECHAM PLC (GB) | 2003-07-02 | — | — | CN | disclosed |