Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 3/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | CSF1R | P07333 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.37 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.37 |
| ▸ | FLT1 | P17948 | 1/20 | 0.37 |
| ▸ | LTK | P29376 | 1/20 | 0.37 |
| ▸ | GRK5 | P34947 | 1/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
| ▸ | CLK2 | P49760 | 1/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | NEK2 | P51955 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18080324 | 0.79 | PDE3B (0.40) | PDE3BPDE3ACHEK1AURKAMAP4K4 | |
| SCHEMBL24550532 | 0.74 | HSD17B10 (0.50) | PDE3BPDE3AALDH1A1LMNAMAPT | |
| SCHEMBL24551105 | 0.69 | GRIN2D (0.43) | PDE3BPDE3AHCAR2ALDH1A1LMNA | |
| SCHEMBL20258124 | 0.69 | LMNA (0.34) | CHEK1AURKAMAP4K4ABL1CSF1R | |
| SCHEMBL18080327 | 0.68 | CHEK1 (0.37) | PDE3BPDE3ACHEK1AURKAMAP4K4 | |
| SCHEMBL13220718 | 0.67 | CA1 (0.39) | EIF4A3TRPV1LMNATSHRHPGD | |
| SCHEMBL12173270 | 0.67 | EIF4A3 (0.42) | EIF4A3TRPV1LMNATSHRHPGD | |
| SCHEMBL12848714 | 0.67 | LMNA (0.33) | CHEK1AURKAMAP4K4ABL1CSF1R | |
| SCHEMBL24550679 | 0.65 | GAA (0.38) | IKBKEALDH1A1LMNAMAPTCYP19A1 | |
| SCHEMBL13377383 | 0.64 | GABRA1 (0.36) | EIF4A3LMNAGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022129281-A1 | NITROGEN CONTAINING 2,3-DIHYDROQUINAZOLINONE COMPOUNDS AS NAV1.8 INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2022-06-23 | — | — | WO | disclosed |