Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 6/20 | 0.53 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.53 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 6/20 | 0.53 |
| ▸ | PDE5A | O76074 | 3/20 | 0.53 |
| ▸ | PDE1A | P54750 | 3/20 | 0.53 |
| ▸ | PDE1B | Q01064 | 3/20 | 0.53 |
| ▸ | PDE1C | Q14123 | 3/20 | 0.53 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.53 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9196954 | 0.83 | PDE4A (0.60) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL10442451 | 0.81 | PDE4A (0.66) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL11017499 | 0.78 | PDE4A (0.65) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL11016023 | 0.78 | PDE4A (0.58) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL11014088 | 0.78 | PDE4A (0.61) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL11016800 | 0.76 | PDE4A (0.56) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL11018621 | 0.76 | PDE4A (0.58) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL9194252 | 0.76 | PDE4A (0.64) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL9191914 | 0.76 | PI4KA (0.47) | — | |
| SCHEMBL9194840 | 0.71 | PDE4A (0.67) | PDE4APDE4BPDE4CPDE4DPDE5A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0668860-A1 | PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES | PHARMACIA & UPJOHN COMPANY (US) | 1995-08-30 | — | — | EP | claimed |
| CN-1029968-C | Process for preparation of N-heteroaryl-purin-6-amines and their use as medicaments | HOECHST ROUSSEL PHARMA (US) | 1995-10-11 | — | — | CN | disclosed |
| EP-0402752-B1 | N-heteroaryl-purin-6-amines, a process for their preparation and their use as medicaments | HOECHST ROUSSEL PHARMA (US) | 1995-09-13 | — | — | EP | disclosed |
| US-5155098-A | Analgesics, anticonvulsants | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1992-10-13 | — | — | US | disclosed |
| US-5017578-A | N-heteroaryl-purin-6-amines useful as analgesic and anticonvulsant agents | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1991-05-21 | — | — | US | disclosed |
| EP-0402752-A1 | N-heteroaryl-purin-6-amines, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1990-12-19 | — | — | EP | disclosed |
| CN-1047866-A | The preparation method of N-heteroaryl-purine-6-amine and medicinal | HOECHST ROUSSEL PHARMA (US) | 1990-12-19 | — | — | CN | disclosed |