Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 4/20 | 0.38 |
| ▸ | HRH1 | P35367 | 3/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL30148102 | 0.85 | AKR1B10 (0.49) | HTR6HRH1AKR1B10AKR1B1AKR1A1 | |
| SCHEMBL28464318 | 0.73 | HDAC6 (0.37) | SLC6A4MAOAMAOBHTR6HRH1 | |
| SCHEMBL30148066 | 0.73 | HDAC6 (0.37) | SLC6A4MAOAMAOBHTR6HRH1 | |
| SCHEMBL28476651 | 0.72 | MAOA (0.39) | SLC6A4MAOAMAOBHTR6HRH1 | |
| SCHEMBL4299142 | 0.71 | KDM4E (0.39) | SLC6A4MAOAMAOBPDE5AKDM4E | |
| SCHEMBL28474518 | 0.69 | CHRM2 (0.46) | SLC6A4HTR6AKR1B10AKR1B1AKR1A1 | |
| SCHEMBL30148132 | 0.65 | MAPKAPK2 (0.55) | SLC6A4DRD2DRD1DRD5DRD3 | |
| SCHEMBL6354132 | 0.65 | MAPKAPK2 (0.47) | SLC6A4MAOAMAOBHTR6HRH1 | |
| SCHEMBL8757820 | 0.64 | MAOA (0.46) | MAOAMAOBHTR6HRH1AKR1B10 | |
| SCHEMBL31291740 | 0.64 | SLC6A4 (0.60) | SLC6A4MAOAMAOBHTR6KDM4E |
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-111675725-B | Tetrahydro-beta-carbaline dimer and preparation method and application thereof | 中国药科大学 | 2023-01-24 | — | — | CN | disclosed |