Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | MAPT | P10636 | 8/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.45 |
| ▸ | GAA | P10253 | 7/20 | 0.45 |
| ▸ | HPGD | P15428 | 6/20 | 0.45 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | NSD2 | O96028 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | SNCA | P37840 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 4/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28945228 | 0.76 | ALDH1A1 (0.56) | KMT2AALDH1A1MAPTKDM4EGAA | |
| SCHEMBL28498322 | 0.75 | KMT2A (0.46) | KMT2AALDH1A1MAPTKDM4EGAA | |
| SCHEMBL21368249 | 0.71 | KDM4E (0.55) | KMT2AALDH1A1MAPTKDM4EGAA | |
| SCHEMBL8317948 | 0.69 | GAA (0.56) | KMT2AALDH1A1MAPTKDM4EGAA | |
| SCHEMBL7964333 | 0.68 | KMT2A (0.51) | KMT2AALDH1A1MAPTKDM4EGAA | |
| SCHEMBL16504030 | 0.68 | GAA (0.50) | KMT2AALDH1A1MAPTKDM4EGAA | |
| SCHEMBL11877859 | 0.67 | KMT2A (0.47) | KMT2AALDH1A1MAPTKDM4EGAA | |
| SCHEMBL13012832 | 0.65 | KMT2A (0.44) | KMT2AALDH1A1MAPTKDM4EGAA | |
| SCHEMBL24074587 | 0.64 | KDM4E (0.75) | KMT2AALDH1A1MAPTKDM4EGAA | |
| SCHEMBL12258293 | 0.64 | KMT2A (0.61) | KMT2AALDH1A1MAPTKDM4EGAA |
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-116478102-A | N-bine organic micromolecule photocatalyst with photoactivity and preparation method and application thereof | 中国科学院大学 | 2023-07-25 | — | — | CN | disclosed |
| CN-109678799-B | Dihydrobenzandazole compound, organic electroluminescent device and display device | 阜阳欣奕华材料科技有限公司 | 2020-12-22 | — | — | CN | disclosed |