Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.56 |
| ▸ | HPGD | P15428 | 8/20 | 0.56 |
| ▸ | MAPT | P10636 | 7/20 | 0.56 |
| ▸ | GAA | P10253 | 6/20 | 0.56 |
| ▸ | NSD2 | O96028 | 5/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | APP | P05067 | 1/20 | 0.54 |
| ▸ | SNCA | P37840 | 1/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20888912 | 0.76 | MAOA (0.40) | ALDH1A1GAAKMT2AMEN1CYP2C19 | |
| SCHEMBL28489824 | 0.76 | KMT2A (0.55) | ALDH1A1KDM4EHPGDMAPTGAA | |
| SCHEMBL24074587 | 0.73 | KDM4E (0.75) | ALDH1A1KDM4EHPGDMAPTGAA | |
| SCHEMBL11954809 | 0.71 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDMAPTGAA | |
| SCHEMBL9161190 | 0.71 | ALDH1A1 (1.00) | ALDH1A1KDM4EHPGDMAPTGAA | |
| SCHEMBL24074561 | 0.70 | ALDH1A1 (0.76) | ALDH1A1KDM4EHPGDMAPTGAA | |
| SCHEMBL9155726 | 0.70 | KDM4E (1.00) | ALDH1A1KDM4EHPGDMAPTGAA | |
| SCHEMBL12258293 | 0.68 | KMT2A (0.61) | ALDH1A1KDM4EHPGDMAPTGAA | |
| SCHEMBL8746617 | 0.68 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDMAPTGAA | |
| SCHEMBL20888834 | 0.68 | CYP2A6 (0.39) | ALDH1A1HPGDKMT2AMEN1CYP1A2 |
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-115513392-A | Organometallic compound and light-emitting element including the same | 三星显示有限公司 | 2022-12-23 | — | — | CN | disclosed |