Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29088816 | 0.83 | CA1 (0.51) | CA1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL21158807 | 0.79 | CA1 (0.57) | CA1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL29088785 | 0.69 | CA1 (0.44) | CA1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL3486328 | 0.69 | CA1 (0.51) | CA1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL13254537 | 0.69 | CA1 (0.51) | CA1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL13254458 | 0.65 | MAPT (0.54) | CA1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL3486103 | 0.65 | MAPT (0.54) | CA1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL13254459 | 0.65 | MAPT (0.54) | CA1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL5373025 | 0.64 | CA1 (0.48) | CA1MAPTKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL28470733 | 0.63 | GRIN1 (0.53) | LMNASLC6A4OPRM1OPRK1 |
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-114805139-B | Prodrugs of ketamine, compositions and uses thereof | 凯瑞康宁生物工程（武汉）有限公司 | 2023-10-20 | — | — | CN | disclosed |