Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.37 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.37 |
| ▸ | UGT1A9 | O60656 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
| ▸ | ALB | P02768 | 1/20 | 0.37 |
| ▸ | UGT1A6 | P19224 | 1/20 | 0.37 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.37 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.37 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29953645 | 0.86 | KDM4E (0.40) | GAAPTGS2CXCL8AKR1B10UGT1A9 | |
| SCHEMBL1122639 | 0.81 | PTK2B (0.49) | AKR1B1PTGS2CXCL8AKR1B10UGT1A9 | |
| SCHEMBL29955119 | 0.77 | CXCL8 (0.40) | PTGS2CXCL8MT-CO2TTRADRA1A | |
| SCHEMBL29950893 | 0.77 | PSIP1 (0.42) | GAATSHRSMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL29955215 | 0.75 | MEN1 (0.53) | POLBKMT2AKDM4EMEN1ALDH1A1 | |
| SCHEMBL29953554 | 0.73 | KDM4E (0.63) | POLBKMT2AKDM4EMEN1SMN1; SMN2 | |
| SCHEMBL29953275 | 0.71 | KMT2A (0.54) | GAAPOLBKMT2AKDM4EMEN1 | |
| SCHEMBL2551665 | 0.70 | KDM4E (0.48) | POLBKMT2AKDM4EMEN1TSHR | |
| SCHEMBL27770371 | 0.68 | HTT (0.36) | POLBKMT2AKDM4EMEN1TSHR | |
| SCHEMBL7264830 | 0.68 | ALDH1A1 (0.51) | POLBKMT2AMEN1PTK2BALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |