Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 3/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9585798 | 0.93 | CYP2D6 (0.50) | PDE4APDE4BPDE4CPDE4DMEN1 | |
| SCHEMBL9585125 | 0.71 | DPP4 (0.38) | MEN1KMT2ACYP1A2CYP2D6TSHR | |
| SCHEMBL9585563 | 0.71 | ADORA3 (0.45) | MEN1KMT2ACYP1A2CYP2D6LMNA | |
| SCHEMBL11074233 | 0.71 | PDE4A (0.45) | PDE4APDE4BPDE4CPDE4DMEN1 | |
| Hydrochloric Acid SCHEMBL10795748 | 0.70 | MEN1 (0.47) | PDE4APDE4BPDE4CPDE4DMEN1 | |
| SCHEMBL11067509 | 0.69 | TSHR (0.50) | PDE4APDE4BPDE4CPDE4DMEN1 | |
| SCHEMBL8123790 | 0.69 | PDE4A (0.79) | PDE4APDE4BPDE4CPDE4DLMNA | |
| Hydrochloric Acid SCHEMBL10795579 | 0.69 | TSHR (0.49) | PDE4APDE4BPDE4CPDE4DMEN1 | |
| SCHEMBL16298420 | 0.68 | TSHR (0.50) | PDE4APDE4BPDE4CPDE4DCYP2D6 | |
| SCHEMBL9585201 | 0.68 | ADORA2A (0.39) | MEN1KMT2ACYP1A2CYP2D6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5270316-A | Condensed purine derivatives | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1993-12-14 | — | — | US | disclosed |