Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 3/20 | 0.37 |
| ▸ | PDE1A | P54750 | 2/20 | 0.37 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | NOX4 | Q9NPH5 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20373449 | 0.84 | SYK (0.38) | PDE1APDE1BPDE1CPLA2G2APDE5A | |
| SCHEMBL20373284 | 0.82 | KDM4E (0.36) | PDE1APDE1BPDE1CPLA2G2AKDM4E | |
| SCHEMBL20373360 | 0.80 | MET (0.40) | KDM4EALDH1A1MCHR1 | |
| SCHEMBL20373452 | 0.79 | KCNA5 (0.40) | PDE1APDE1BPDE1CPLA2G2APDE5A | |
| SCHEMBL20373445 | 0.79 | TLR7 (0.33) | S1PR3PDE1APDE1BPDE1CPLA2G2A | |
| SCHEMBL20373357 | 0.78 | NOX4 (0.43) | KDM4EALDH1A1TSHRNOX4MCHR1 | |
| SCHEMBL20373280 | 0.78 | POLB (0.37) | PDE1APDE1BPDE1CPLA2G2AEGFR | |
| SCHEMBL20373361 | 0.77 | AVPR2 (0.34) | KDM4EALDH1A1NOX4KCNH2MCHR1 | |
| SCHEMBL20373754 | 0.77 | TLR7 (0.37) | KDM4ESMN1; SMN2NOX4GRIN1GRIN2B | |
| SCHEMBL20373588 | 0.75 | BRD4 (0.37) | S1PR3PDE1BPDE5ANOX4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3092227-B1 | BICYCLIC HETEROCYCLIC DERIVATIVES AS BROMODOMAIN INHIBITORS | ORION CORP (FI) | 2018-07-11 | — | — | EP | disclosed |