Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | PDE1A | P54750 | 2/20 | 0.32 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.32 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
| ▸ | PDE5A | O76074 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | CLPP | Q16740 | 1/20 | 0.30 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11273417 | 0.86 | CYP3A4 (0.32) | CYP3A4SMN1; SMN2HIF1ATSHR | |
| SCHEMBL11067126 | 0.80 | MEN1 (0.46) | TSHRLMNACYP2D6 | |
| SCHEMBL10800851 | 0.78 | P2RX7 (0.35) | PDE1APDE1BPDE1CPDE2A | |
| SCHEMBL10798396 | 0.78 | TSHR (0.55) | CYP3A4SMN1; SMN2HIF1ATSHRCYP2D6 | |
| SCHEMBL10800850 | 0.74 | KMT2A (0.45) | CYP3A4SMN1; SMN2HIF1ATSHRLMNA | |
| SCHEMBL11070880 | 0.70 | MEN1 (0.44) | TSHRLMNACYP2D6 | |
| SCHEMBL10800858 | 0.68 | TSHR (0.33) | CYP3A4SMN1; SMN2HIF1ATSHRLMNA | |
| SCHEMBL11089172 | 0.68 | ADORA2A (0.36) | CYP3A4SMN1; SMN2HIF1APDE1APDE1B | |
| SCHEMBL11072135 | 0.66 | MEN1 (0.43) | CYP3A4SMN1; SMN2HIF1ATSHRLMNA | |
| SCHEMBL10798493 | 0.65 | TSHR (0.54) | CYP3A4SMN1; SMN2HIF1ATSHRLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4489078-A | Diazaheterocyclopurines used as anti-broncho spasmatics and vasodilators | MEAD JOHNSON & COMPANY (US) | 1984-12-18 | — | — | US | claimed |
| US-4366156-A | Antiallergic methods using diazaheterocyclopurines | MEAD JOHNSON & COMPANY (US) | 1982-12-28 | — | — | US | claimed |
| US-4298734-A | PHOSPHODIESTERASE INHIBITORS, BRONCHODILATORS, PERIPHERAL VASODILATORS | MEAD JOHNSON & COMPANY (US) | 1981-11-03 | — | — | US | claimed |