Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5A | P29375 | 3/20 | 0.44 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.38 |
| ▸ | BRD4 | O60885 | 3/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.36 |
| ▸ | PDE9A | O76083 | 3/20 | 0.35 |
| ▸ | VNN1 | O95497 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 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 | |
|---|---|---|---|---|
| SCHEMBL4751829 | 0.78 | KDR (0.58) | KDM5AKDRADORA3CHUKPDE9A | |
| SCHEMBL28290672 | 0.71 | KDM5A (0.40) | KDM5ACHEK1CHEK2PDE9AKDM4C | |
| SCHEMBL4753880 | 0.68 | KDR (0.61) | KDM5ABRD4KDR | |
| SCHEMBL19984551 | 0.67 | KDM5A (0.67) | KDM5AKDM5BADORA3ADORA2AADORA1 | |
| SCHEMBL30474111 | 0.67 | KDM5A (0.67) | KDM5AKDM5BADORA3ADORA2AADORA1 | |
| SCHEMBL20012152 | 0.64 | GRIA1 (0.38) | ADORA1PDE10A | |
| SCHEMBL3242090 | 0.63 | KDM5A (1.00) | KDM5AKDM5BADORA3ADORA2AADORA1 | |
| SCHEMBL4756721 | 0.63 | KDM5A (0.65) | KDM5ACHUK | |
| SCHEMBL30064094 | 0.63 | KDM5A (1.00) | KDM5AKDM5BADORA3ADORA2AADORA1 | |
| SCHEMBL246359 | 0.63 | KDM5A (0.65) | KDM5AKDM5BADORA3ADORA2AADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109575016-A | PDE9 inhibitors and uses thereof | 南京药捷安康生物科技有限公司 | 2019-04-05 | — | — | CN | disclosed |