Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 6/20 | 0.33 |
| ▸ | CDK8 | P49336 | 6/20 | 0.33 |
| ▸ | GPR39 | O43194 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | GSK3A | P49840 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 1/20 | 0.30 |
| ▸ | BTK | Q06187 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16610667 | 0.78 | CDK8 (0.36) | CCNCCDK8KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL16610738 | 0.75 | KDM4E (0.37) | CCNCCDK8PDE2AKDM4EALDH1A1 | |
| SCHEMBL16610790 | 0.72 | KDR (0.38) | CCNCCDK8KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL16610821 | 0.72 | KDR (0.38) | CCNCCDK8KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL16610967 | 0.70 | MAP3K12 (0.35) | CDK8GPR39GSK3ACDK9JAK3 | |
| SCHEMBL16610787 | 0.70 | MAP3K12 (0.35) | CDK8GPR39GSK3ACDK9JAK3 | |
| SCHEMBL28004266 | 0.68 | PDE2A (0.41) | CCNCCDK8PDE2AKDM4EALDH1A1 | |
| SCHEMBL16610688 | 0.67 | KDR (0.40) | JAK3 | |
| SCHEMBL16610603 | 0.67 | KDR (0.40) | JAK3 | |
| SCHEMBL28004257 | 0.66 | CYP11B2 (0.37) | CCNCCDK8PDE2AKDM4EALDH1A1 |
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-2857398-A1 | AROMATIC HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL | Nippon Shinyaku Co., Ltd. (JP) | 2015-04-08 | — | — | EP | disclosed |