Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | CXCR3 | P49682 | 3/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24316331 | 0.88 | PDK2 (0.40) | PDK2CXCR3HSD11B1ADORA1CHRM1 | |
| SCHEMBL24316335 | 0.83 | HSD11B1 (0.33) | PDK2CXCR3HSD11B1KDM4ENPC1 | |
| SCHEMBL25035892 | 0.80 | PDK2 (0.35) | PDK2CXCR3HCRTR1HCRTR2HSD11B1 | |
| SCHEMBL23606148 | 0.78 | PDK2 (0.48) | PDK2HSD11B1CHRM1CHRM3KDM4E | |
| SCHEMBL25054827 | 0.78 | PDK2 (0.48) | PDK2HSD11B1CHRM1CHRM3KDM4E | |
| SCHEMBL25038269 | 0.77 | CYP2A6 (0.40) | PDK2HSD11B1 | |
| SCHEMBL24316343 | 0.75 | SLC6A3 (0.40) | PDK2HSD11B1KDM4ENPC1ALDH1A1 | |
| SCHEMBL24618564 | 0.75 | PDK2 (0.43) | PDK2CXCR3HSD11B1ALDH1A1LMNA | |
| SCHEMBL24316404 | 0.75 | KMT2A (0.37) | PDK2HSD11B1CHRM1KDM4ENPC1 | |
| SCHEMBL24316388 | 0.73 | CYP1A2 (0.40) | PDK2CXCR3HSD11B1ADORA1CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022068292-A1 | ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME | 陕西莱特光电材料股份有限公司 | 2022-04-07 | — | — | WO | disclosed |