Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 2/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 2/20 | 0.32 |
| ▸ | JAK1 | P23458 | 2/20 | 0.32 |
| ▸ | TYK2 | P29597 | 2/20 | 0.32 |
| ▸ | JAK3 | P52333 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7305960 | 0.86 | KDM4E (0.38) | PDE3BPDE3ASMN1; SMN2MT-CO2ALDH1A1 | |
| SCHEMBL7315403 | 0.76 | SLC10A2 (0.37) | MT-CO2ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL7317441 | 0.73 | KDM4E (0.39) | PDE3BPDE3ASMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL7307946 | 0.69 | PDE3B (0.54) | PDE3BPDE3AKDM4ETNF | |
| SCHEMBL7312102 | 0.67 | PDE3B (0.46) | PDE3BPDE3ASMN1; SMN2ALDH1A1KDM4E | |
| Fluoride SCHEMBL7318311 | 0.67 | PDE3B (0.35) | PDE3BPDE3ASMN1; SMN2MT-CO2 | |
| SCHEMBL8708452 | 0.65 | MT-CO2 (0.36) | SMN1; SMN2MT-CO2ALDH1A1HPGD | |
| SCHEMBL490924 | 0.64 | PKM (0.48) | MT-CO2ALDH1A1CYP3A4CYP2C9KDM4E | |
| SCHEMBL5022505 | 0.63 | CYP2C19 (0.54) | SMN1; SMN2MT-CO2ALDH1A1CYP2C9HPGD | |
| SCHEMBL31083332 | 0.63 | CYP2C19 (0.54) | SMN1; SMN2MT-CO2ALDH1A1CYP2C9HPGD |
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 |