Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | FPR1 | P21462 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
| ▸ | TUBA3C | P0DPH7 | 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 | |
|---|---|---|---|---|
| SCHEMBL28575976 | 1.00 | ALDH1A1 (0.39) | ALDH1A1MAPTNPSR1HPGDTDP1 | |
| SCHEMBL28595342 | 0.91 | MAPT (0.42) | ALDH1A1MAPTNPSR1HPGDTDP1 | |
| SCHEMBL28595345 | 0.91 | MAPT (0.42) | ALDH1A1MAPTNPSR1HPGDTDP1 | |
| SCHEMBL28599970 | 0.82 | POLB (0.38) | ALDH1A1MAPTNPSR1HPGDTDP1 | |
| SCHEMBL28599968 | 0.82 | POLB (0.38) | ALDH1A1MAPTNPSR1HPGDTDP1 | |
| SCHEMBL29853075 | 0.81 | HIF1A (0.39) | HIF1AKDM4ETUBB1ESR1ESR2 | |
| SCHEMBL19422914 | 0.81 | HIF1A (0.39) | HIF1AKDM4ETUBB1ESR1ESR2 | |
| SCHEMBL22773169 | 0.81 | HIF1A (0.39) | HIF1AKDM4ETUBB1ESR1ESR2 | |
| Morpholine SCHEMBL28916450 | 0.80 | MAPT (0.38) | ALDH1A1MAPTNPSR1HPGDTDP1 | |
| SCHEMBL22773198 | 0.78 | HIF1A (0.40) | HIF1AKDM4ETUBB1ESR1ESR2 |
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-107235883-B | Diaryl-beta-lactam compound, preparation method thereof and application thereof in pharmacy | 复旦大学 | 2021-06-29 | — | — | CN | disclosed |