Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.54 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | HMGCR | P04035 | 2/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | TNF | P01375 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.33 |
| ▸ | RPS6KB2 | Q9UBS0 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 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 | |
|---|---|---|---|---|
| SCHEMBL7305966 | 0.86 | PDE3B (0.57) | PDE3BPDE3AKDM4EBACE1HMGCR | |
| SCHEMBL7311043 | 0.80 | PDE3B (0.50) | PDE3BPDE3AKDM4EBACE1HMGCR | |
| SCHEMBL7315407 | 0.76 | PDE3B (0.46) | PDE3BPDE3AKDM4EBACE1TSHR | |
| SCHEMBL7313861 | 0.74 | PDE3B (0.44) | PDE3BPDE3AKDM4ETNFPDE10A | |
| SCHEMBL7317446 | 0.74 | TP53 (0.44) | PDE3BPDE3AKDM4EPDE10A | |
| SCHEMBL7309250 | 0.72 | PDE3B (0.44) | PDE3BPDE3AKDM4EHMGCRTSHR | |
| SCHEMBL7319613 | 0.69 | ALDH1A1 (0.41) | PDE3BPDE3AKDM4ETSHR | |
| SCHEMBL7307941 | 0.69 | PDE3B (0.35) | PDE3BPDE3AKDM4ETNF | |
| SCHEMBL13183946 | 0.68 | TSHR (0.41) | PDE3BPDE3AKDM4EEGFRSRC | |
| SCHEMBL22307576 | 0.66 | TSHR (0.43) | PDE3BPDE3AKDM4EEGFRSRC |
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-4822800-A | Isoquinolinol compounds having cardiotonic and phosphodiesterase fraction III inhibiting properties and/or renal vasodilating properties | ORTHO PHARMACEUTICAL CORPORATION (US) | 1989-04-18 | — | — | US | disclosed |