Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 2/20 | 0.52 |
| ▸ | PDE1A | P54750 | 1/20 | 0.52 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.52 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.52 |
| ▸ | PDE4D | Q08499 | 14/20 | 0.51 |
| ▸ | PDE4A | P27815 | 10/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 10/20 | 0.51 |
| ▸ | PDE4C | Q08493 | 10/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | P2RX3 | P56373 | 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 | |
|---|---|---|---|---|
| SCHEMBL6605978 | 0.92 | PDE5A (0.51) | PDE5APDE1APDE1BPDE1CPDE4D | |
| SCHEMBL6581707 | 0.91 | PDE4D (0.51) | PDE5APDE1APDE1BPDE1CPDE4D | |
| SCHEMBL6582350 | 0.89 | PDE4D (0.49) | PDE5APDE1APDE1BPDE1CPDE4D | |
| SCHEMBL6607012 | 0.89 | PDE4B (0.52) | PDE5APDE1APDE1BPDE1CPDE4D | |
| SCHEMBL6602063 | 0.89 | PDE4B (0.52) | PDE5APDE1APDE1BPDE1CPDE4D | |
| SCHEMBL145758 | 0.89 | PDE5A (0.49) | PDE5APDE1APDE1BPDE1CPDE4D | |
| SCHEMBL6602086 | 0.89 | PDE5A (0.49) | PDE5APDE1APDE1BPDE1CPDE4D | |
| SCHEMBL6581786 | 0.89 | PDE4B (0.49) | PDE5APDE1APDE1BPDE1CPDE4D | |
| SCHEMBL6579386 | 0.88 | ALDH1A1 (0.43) | MEN1MAPK1KMT2A | |
| SCHEMBL6602629 | 0.88 | PDE4B (0.55) | PDE4DPDE4APDE4BPDE4C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1194411-B1 | BENZOYLPYRIDAZINES | MERCK PATENT GMBH (DE) | 2004-06-16 | — | — | EP | disclosed |
| US-6696446-B1 | HETEROCYLCIC AMIDES SUCH AS N-(4-(3-(3-(3-ETHOXY-4-METHOXY PHENYL)-1,4,5,6-TETRAHYDRO-1-PYRIDAZINYLCARBONYL)PHENYLAMINO -CARBONYL)PHENYL)-4-NITROBENZAMIDE, SUED AS PHOSPHODIESTERASE INHIBITORSFOR PROPHYLAXIS OF ALLERGIES OR ASTHMA | MERCK PATENT GMBH (DE) | 2004-02-24 | — | — | US | disclosed |