Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 18/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18362212 | 1.00 | PDE2A (0.50) | PDE2AKDM4EALDH1A1 | |
| SCHEMBL20164024 | 0.86 | PDE2A (0.49) | PDE2A | |
| SCHEMBL20164023 | 0.86 | PDE2A (0.49) | PDE2A | |
| SCHEMBL20164051 | 0.86 | PDE2A (0.49) | PDE2A | |
| SCHEMBL18362216 | 0.84 | PDE2A (0.51) | PDE2AKDM4EALDH1A1 | |
| SCHEMBL18362236 | 0.78 | PDE2A (0.63) | PDE2A | |
| SCHEMBL20175962 | 0.76 | PDE2A (0.37) | PDE2AKDM4EALDH1A1 | |
| SCHEMBL20175968 | 0.76 | PDE2A (0.37) | PDE2AKDM4EALDH1A1 | |
| SCHEMBL18362086 | 0.76 | PDE2A (0.61) | PDE2A | |
| SCHEMBL18362211 | 0.74 | PDE2A (0.38) | PDE2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017003895-A1 | BICYCLIC HETEROCYCLIC COMPOUNDS AS PDE2 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2017-01-05 | — | — | WO | disclosed |
| WO-2017000276-A1 | BICYCLIC HETEROCYCLIC COMPOUNDS AS PDE2 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2017-01-05 | — | — | WO | disclosed |