Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | PDE1A | P54750 | 1/20 | 0.33 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.33 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.33 |
| ▸ | LYN | P07948 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.33 |
| ▸ | CCND1 | P24385 | 1/20 | 0.33 |
| ▸ | CCND2 | P30279 | 1/20 | 0.33 |
| ▸ | CCND3 | P30281 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 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 | |
|---|---|---|---|---|
| SCHEMBL20373449 | 0.90 | SYK (0.38) | KCNA5ALOX5APPDE1APDE1BPDE1C | |
| SCHEMBL20373360 | 0.86 | MET (0.40) | KDM4EALDH1A1MCHR1 | |
| SCHEMBL20373452 | 0.85 | KCNA5 (0.40) | KCNA5ALOX5APPDE1APDE1BPDE1C | |
| SCHEMBL20373445 | 0.85 | TLR7 (0.33) | KDM4EALDH1A1KCNA5ALOX5APPDE1A | |
| SCHEMBL20373357 | 0.84 | NOX4 (0.43) | KDM4EALDH1A1MCHR1NOX4CNR2 | |
| SCHEMBL20373754 | 0.84 | TLR7 (0.37) | KDM4ETLR7NOX4SMN1; SMN2NTRK1 | |
| SCHEMBL20373361 | 0.83 | AVPR2 (0.34) | KDM4EALDH1A1ALOX5APMCHR1TLR7 | |
| SCHEMBL20373288 | 0.82 | S1PR3 (0.37) | KDM4EALDH1A1MCHR1PDE1APDE1B | |
| SCHEMBL20373588 | 0.81 | BRD4 (0.37) | PDE1BTLR7NOX4 | |
| SCHEMBL20373279 | 0.77 | PDE1A (0.40) | KDM4EALDH1A1PDE1APDE1BPDE1C |
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 |