Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 4/20 | 0.69 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.69 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.69 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.69 |
| ▸ | SLC40A1 | Q9NP59 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | G6PD | P11413 | 1/20 | 0.44 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.44 |
| ▸ | METAP2 | P50579 | 1/20 | 0.44 |
| ▸ | METAP1 | P53582 | 1/20 | 0.44 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044260 | 0.82 | PDE4A (0.70) | PDE4APDE4BPDE4CPDE4DSLC40A1 | |
| SCHEMBL4044216 | 0.82 | PDE4A (1.00) | PDE4APDE4BPDE4CPDE4DSLC40A1 | |
| SCHEMBL13849020 | 0.73 | PDE4A (0.79) | PDE4APDE4BPDE4CPDE4DSLC40A1 | |
| SCHEMBL28470500 | 0.69 | ALDH1A1 (0.59) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL13849016 | 0.69 | PDE4A (0.76) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL22056988 | 0.67 | BRD4 (0.46) | PDE4APDE4BPDE4CPDE4DMETAP2 | |
| SCHEMBL4035913 | 0.65 | PDE4A (0.53) | PDE4APDE4BPDE4CPDE4DMETAP2 | |
| SCHEMBL4046438 | 0.65 | PDE4A (0.55) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4042250 | 0.65 | PDE4A (0.68) | PDE4APDE4BPDE4CPDE4DKMT2A | |
| SCHEMBL1850691 | 0.65 | IMPDH2 (0.57) | PDE4APDE4BPDE4CPDE4DALDH1A1 |
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-1487797-A1 | HETERO-BRIDGE SUBSTITUTED 8-ARYLQUINOLINE PDE4 INHIBITORS | Merck Frosst Canada & Co. (CA) | 2004-12-22 | — | — | EP | disclosed |
| WO-2003078397-A1 | HETERO-BRIDGE SUBSTITUTED 8-ARYLQUINOLINE PDE4 INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2003-09-25 | — | — | WO | disclosed |