Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 11/20 | 0.40 |
| ▸ | KDR | P35968 | 3/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | FLT1 | P17948 | 2/20 | 0.32 |
| ▸ | FLT4 | P35916 | 2/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | ACVR2A | P27037 | 1/20 | 0.31 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.31 |
| ▸ | PLK4 | O00444 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.31 |
| ▸ | INSR | P06213 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | MARK3 | P27448 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15308505 | 0.79 | PDE2A (0.41) | PDE2AKDRHSD11B1PDE10APDE3A | |
| SCHEMBL17052866 | 0.77 | PDE2A (0.44) | PDE2AKDRHSD11B1PDE10APDE3A | |
| SCHEMBL15306541 | 0.77 | PDE2A (0.39) | PDE2AKDRHSD11B1PDE10APDE3A | |
| SCHEMBL21893829 | 0.76 | SMPD3 (0.48) | PDE2AKDRHSD11B1 | |
| SCHEMBL3772458 | 0.76 | PRKAB2 (0.37) | KDRFLT1FLT4PLK4AURKA | |
| Hydrochloric Acid SCHEMBL22835004 | 0.74 | SMPD3 (0.47) | PDE2AKDRHSD11B1 | |
| SCHEMBL15344923 | 0.73 | PDE2A (0.44) | PDE2AKDRHSD11B1PDE10APDE3A | |
| SCHEMBL9728946 | 0.72 | CDK2 (0.53) | PDE2AKDRHSD11B1CDK2CLK4 | |
| SCHEMBL29291264 | 0.72 | PDE2A (0.37) | PDE2AKDRHSD11B1PDE10APDE3A | |
| SCHEMBL29935585 | 0.72 | PDE2A (0.40) | PDE2AKDRHSD11B1PDE10APDE3A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016054491-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | INFINITY PHARMACEUTICALS, INC. (US) | 2016-04-07 | — | — | WO | disclosed |
| WO-2015051241-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | INFINITY PHARMACEUTICALS, INC. (US) | 2015-04-09 | — | — | WO | disclosed |
| WO-2015051244-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | INFINITY PHARMACEUTICALS, INC. (US) | 2015-04-09 | — | — | WO | disclosed |