Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1S | Q13698 | 8/20 | 0.57 |
| ▸ | HRH1 | P35367 | 5/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | DRD2 | P14416 | 4/20 | 0.46 |
| ▸ | HTR6 | P50406 | 4/20 | 0.46 |
| ▸ | HTR1A | P08908 | 3/20 | 0.46 |
| ▸ | HTR2A | P28223 | 3/20 | 0.46 |
| ▸ | HTR7 | P34969 | 3/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.46 |
| ▸ | DRD1 | P21728 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 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 | |
|---|---|---|---|---|
| SCHEMBL5629416 | 0.81 | CACNA1S (0.57) | CACNA1SHRH1SLC6A4LMNAMAPT | |
| SCHEMBL16536186 | 0.81 | SLC6A4 (0.51) | CACNA1SHRH1SLC6A4LMNAMAPT | |
| SCHEMBL16547305 | 0.81 | SLC6A4 (0.51) | CACNA1SHRH1SLC6A4LMNAMAPT | |
| Hydrochloric Acid SCHEMBL16535503 | 0.80 | CACNA1S (0.50) | CACNA1SHRH1SLC6A4LMNAMAPT | |
| SCHEMBL10695532 | 0.77 | TSHR (0.65) | HRH1SLC6A4TSHRKMT2ADRD2 | |
| SCHEMBL30489285 | 0.77 | TSHR (0.65) | HRH1SLC6A4TSHRKMT2ADRD2 | |
| SCHEMBL6281910 | 0.76 | HTR7 (0.53) | DRD2HTR1AHTR7CHRM2ADRA1A | |
| SCHEMBL7380215 | 0.76 | CACNA1S (0.52) | CACNA1SHRH1SLC6A4LMNAMAPT | |
| SCHEMBL11311320 | 0.74 | DRD2 (0.64) | DRD2HTR1AHTR7CHRM2ADRA1A | |
| SCHEMBL10609946 | 0.73 | CACNA1S (1.00) | CACNA1S |
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 |
|---|---|---|---|---|---|---|---|
| US-4778793-A | CONTROLLING CALCIUM CONCENTRATION-CARDIOVASCULAR DISORDERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-10-18 | — | — | US | disclosed |