Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HRH2 | P25021 | 2/20 | 0.46 |
| ▸ | HRH1 | P35367 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 3/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | HTR1A | P08908 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | VNN1 | O95497 | 1/20 | 0.43 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7447765 | 1.00 | HDAC1 (0.50) | HDAC1HDAC8HRH2HRH1DRD3 | |
| SCHEMBL7447775 | 1.00 | HDAC1 (0.50) | HDAC1HDAC8HRH2HRH1DRD3 | |
| SCHEMBL7450601 | 0.96 | HDAC1 (0.48) | HDAC1HDAC8HRH2HRH1DRD3 | |
| SCHEMBL7453229 | 0.96 | HDAC1 (0.48) | HDAC1HDAC8HRH2HRH1DRD3 | |
| SCHEMBL7445946 | 0.96 | HDAC1 (0.48) | HDAC1HDAC8HRH2HRH1DRD3 | |
| SCHEMBL7449760 | 0.93 | HDAC1 (0.48) | HDAC1HDAC8HRH2HRH1DRD3 | |
| SCHEMBL7449758 | 0.93 | HDAC1 (0.48) | HDAC1HDAC8HRH2HRH1DRD3 | |
| SCHEMBL7450758 | 0.93 | HDAC1 (0.48) | HDAC1HDAC8HRH2HRH1DRD3 | |
| SCHEMBL7446680 | 0.89 | HTR1A (0.47) | HDAC1HDAC8HRH2HRH1DRD3 | |
| SCHEMBL7448117 | 0.89 | HTR1A (0.47) | HDAC1HDAC8HRH2HRH1DRD3 |
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-2000003712-A1 | 1-4-DIHYDROPYRIDINES WITH PYRIDINYL GROUP AS CALCIUM BLOCKERS | LABORATOIRE L. LAFON (FR) | 2000-01-27 | — | — | WO | disclosed |