Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KMO | O15229 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL31193157 | 0.82 | TSHR (0.43) | KDM4EL3MBTL1ALDH1A1GAAHTT | |
| SCHEMBL28500268 | 0.81 | TLR9 (0.42) | KDRKDM4EMAPTALDH1A1GAA | |
| SCHEMBL30009200 | 0.79 | BACE1 (0.46) | AURKAAURKBKDREGLN1KDM4E | |
| SCHEMBL25412037 | 0.78 | PDE10A (0.60) | KDM4EMAPTALDH1A1GAAPDE10A | |
| SCHEMBL30134360 | 0.78 | PDE10A (0.41) | MAPTALDH1A1PDE10AMEN1KMT2A | |
| SCHEMBL31043135 | 0.78 | HTT (0.41) | GLAPTGDR2ALDH1A1GAAHTT | |
| SCHEMBL1641523 | 0.78 | HDAC1 (0.52) | AURKAAURKBKDREGLN1KDM4E | |
| SCHEMBL17179171 | 0.77 | HTT (0.41) | MAPTALDH1A1PDE10AMEN1KMT2A | |
| SCHEMBL23093834 | 0.77 | PDE10A (0.40) | MAPTALDH1A1PDE10AMEN1KMT2A | |
| SCHEMBL30192121 | 0.77 | PABPC1 (0.41) | MAPTALDH1A1PDE10AMEN1KMT2A |
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-112125889-A | Preparation method of 7-bromo-2- (1-methyl-1H-pyrazol-4-yl) quinoxaline | 苏州明锐医药科技有限公司 | 2020-12-25 | — | — | CN | claimed |