Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.60 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.51 |
| ▸ | DRD2 | P14416 | 8/20 | 0.49 |
| ▸ | DRD3 | P35462 | 6/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 3/20 | 0.46 |
| ▸ | HTR2A | P28223 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL24588687 | 0.81 | SLC6A2 (0.44) | KCNH2SLC6A2SLC6A4HRH4DRD2 | |
| SCHEMBL29744148 | 0.81 | SLC6A2 (0.44) | KCNH2SLC6A2SLC6A4HRH4DRD2 | |
| SCHEMBL602069 | 0.81 | HRH4 (0.76) | HRH4DRD2DRD3HTR1A | |
| SCHEMBL603388 | 0.81 | HRH4 (0.74) | HRH4DRD2DRD3HTR1A | |
| SCHEMBL602185 | 0.81 | HRH4 (0.74) | HRH4DRD2DRD3HTR1A | |
| SCHEMBL6141991 | 0.81 | HRH4 (0.74) | HRH4DRD2DRD3HTR1A | |
| SCHEMBL24588742 | 0.80 | HRH4 (0.52) | SLC6A2SLC6A4HRH4HRH3KDM4E | |
| SCHEMBL24588438 | 0.80 | DRD3 (0.56) | SLC6A2SLC6A4DRD2DRD3KDM4E | |
| SCHEMBL29744081 | 0.80 | DRD3 (0.56) | SLC6A2SLC6A4DRD2DRD3KDM4E | |
| SCHEMBL7024844 | 0.78 | FLT3 (0.62) | HRH4HRH3KDM4EHSD17B10AKR1C3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022136486-A1 | CONOLIDINE ANALOGUES AS SELECTIVE ACKR3 MODULATORS FOR THE TREATMENT OF CANCER AND CARDIOVASCULAR DISEASES | LUXEMBOURG INSTITUTE OF HEALTH (LIH) (LU) | 2022-06-30 | — | — | WO | disclosed |