Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1A | P54750 | 6/20 | 0.52 |
| ▸ | PDE1B | Q01064 | 6/20 | 0.52 |
| ▸ | PDE1C | Q14123 | 6/20 | 0.52 |
| ▸ | PDE5A | O76074 | 5/20 | 0.52 |
| ▸ | PDE2A | O00408 | 3/20 | 0.52 |
| ▸ | CFTR | P13569 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | PDE4A | P27815 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
| ▸ | SCN1A | P35498 | 1/20 | 0.52 |
| ▸ | PDE6C | P51160 | 1/20 | 0.52 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.52 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.52 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.52 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.52 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.52 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9037765 | 0.80 | RXFP1 (0.50) | CYP1A2TSHRPDE4AADORA1PDE4B | |
| SCHEMBL10370620 | 0.80 | PDE1A (0.54) | PDE1APDE1BPDE1CPDE5APDE2A | |
| SCHEMBL6641641 | 0.73 | EEF2K (0.54) | CYP1A2CYP3A4TSHRPDE4AMAPK1 | |
| SCHEMBL8173081 | 0.73 | PDE4A (0.53) | PDE5APDE2ATSHRPDE4AADORA1 | |
| SCHEMBL5410997 | 0.71 | PDE1A (0.55) | PDE1APDE1BPDE1CPDE5APDE2A | |
| SCHEMBL9038623 | 0.71 | PDE1A (0.54) | PDE1APDE1BPDE1CPDE5APDE2A | |
| SCHEMBL10371053 | 0.69 | PDE1A (0.56) | PDE1APDE1BPDE1CPDE5APDE2A | |
| Isobutylmethylxanthine SCHEMBL7637581 | 0.69 | PDE4A (0.94) | PDE1APDE1BPDE1CPDE5APDE2A | |
| SCHEMBL4811164 | 0.69 | ALDH1A1 (0.60) | PDE1APDE1BPDE1CPDE5APDE2A | |
| Isobutylmethylxanthine SCHEMBL50315 | 0.69 | PDE4A (1.00) | PDE1APDE1BPDE1CPDE5APDE2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0696590-A1 | Pyrido[2,3-d]pyrimidine derivatives, their preparation and their use as anti-asthma agents | NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) | 1996-02-14 | — | — | EP | disclosed |