Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.35 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20373585 | 0.85 | POLB (0.38) | PDE4APDE4BPDE4CPDE4DMEN1 | |
| SCHEMBL18326376 | 0.83 | PDE4D (0.43) | PDE4APDE4BPDE4CPDE4DGABRA1 | |
| SCHEMBL16906011 | 0.77 | BRD4 (0.43) | PDE4APDE4BPDE4CPDE4DGABRA1 | |
| SCHEMBL20357574 | 0.71 | BRD4 (0.41) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL20373279 | 0.70 | PDE1A (0.40) | MEN1KMT2AGABRA1GABRA5ALDH1A1 | |
| SCHEMBL20373281 | 0.68 | RECQL (0.38) | MEN1KMT2AALDH1A1TSHRMAPK1 | |
| SCHEMBL18308331 | 0.64 | RECQL (0.35) | MEN1KMT2AALDH1A1TSHRHSD17B10 | |
| SCHEMBL18359530 | 0.64 | PDE1A (0.37) | MEN1KMT2AALDH1A1POLBKDM4E | |
| SCHEMBL20373789 | 0.64 | PDE10A (0.41) | KMT2AACHE | |
| SCHEMBL16905989 | 0.63 | HTR2A (0.45) | PDE4APDE4BPDE4CPDE4DMEN1 |
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 |