Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 6/20 | 0.46 |
| ▸ | CCR2 | P41597 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | ECE1 | P42892 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30593227 | 0.92 | ECE1 (0.44) | KIF11CCR2KDM4EBRD4ALDH1A1 | |
| SCHEMBL30593296 | 0.88 | DRD2 (0.41) | KIF11KDM4EHSD11B1LMNAMAPT | |
| SCHEMBL29084839 | 0.88 | DRD2 (0.41) | KIF11KDM4EHSD11B1LMNAMAPT | |
| SCHEMBL30593300 | 0.86 | DRD2 (0.49) | KIF11KDM4EBRD4ALDH1A1POLB | |
| SCHEMBL31083691 | 0.84 | KIF11 (0.41) | KIF11CCR2KDM4EBRD4ALDH1A1 | |
| SCHEMBL31070623 | 0.83 | ECE1 (0.40) | KIF11CCR2KDM4EBRD4ALDH1A1 | |
| SCHEMBL31083744 | 0.82 | PDE4D (0.45) | KIF11HSD11B1LMNAMAPTPDE4D | |
| SCHEMBL31083723 | 0.82 | KIF11 (0.41) | KIF11CCR2KDM4EBRD4ALDH1A1 | |
| SCHEMBL31083762 | 0.82 | KIF11 (0.41) | KIF11CCR2KDM4EBRD4ALDH1A1 | |
| SCHEMBL31083773 | 0.82 | PDE4D (0.47) | KIF11HSD11B1LMNAMAPTPDE4D |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118742543-A | Dihydro isoquinoline compound and medical application thereof | 中国科学院上海药物研究所 | 2024-10-01 | — | — | CN | disclosed |
| CN-116789641-A | Dihydro isoquinoline compound and medical application thereof | 中国科学院上海药物研究所 | 2023-09-22 | — | — | CN | disclosed |