Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | PDE4A | P27815 | 2/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.47 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.47 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL8180824 | 0.92 | ALDH1A1 (0.51) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8179541 | 0.92 | PDE4A (0.50) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| Bicarbonate SCHEMBL7017359 | 0.90 | PTPN12 (0.47) | ALDH1A1PTPN12PTPN22MAPTLMNA | |
| SCHEMBL8178383 | 0.86 | ALDH1A1 (0.51) | ALDH1A1PTPN12PTPN22MAPTLMNA | |
| SCHEMBL8179485 | 0.86 | ALDH1A1 (0.49) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8177034 | 0.86 | PDE4A (0.64) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8183118 | 0.85 | ALDH1A1 (0.59) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8172347 | 0.85 | PDE4A (0.52) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8181994 | 0.85 | ALDH1A1 (0.52) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8184394 | 0.85 | PTPN12 (0.64) | ALDH1A1PDE4APDE4BPDE4CPDE4D |
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-6130223-A | Thienopyrimidine with phosphodiesterase V inhibiting effect | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2000-10-10 | — | — | US | disclosed |