Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.57 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.57 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.57 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.57 |
| ▸ | CDK1 | P06493 | 5/20 | 0.43 |
| ▸ | CDK2 | P24941 | 4/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.43 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | MGMT | P16455 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16146158 | 0.79 | PDE4A (0.64) | PDE4APDE4BPDE4CPDE4DCDK1 | |
| SCHEMBL104931 | 0.79 | PDE4A (0.64) | PDE4APDE4BPDE4CPDE4DCDK1 | |
| SCHEMBL29557469 | 0.79 | PDE4A (0.64) | PDE4APDE4BPDE4CPDE4DCDK1 | |
| Phosphoric Acid SCHEMBL27565804 | 0.78 | PDE4A (0.56) | PDE4APDE4BPDE4CPDE4DCDK1 | |
| SCHEMBL16146389 | 0.77 | PDE4A (0.65) | PDE4APDE4BPDE4CPDE4DCDK1 | |
| SCHEMBL3757593 | 0.76 | PDE4A (0.64) | PDE4APDE4BPDE4CPDE4DCDK1 | |
| SCHEMBL16147211 | 0.75 | PDE4A (0.75) | PDE4APDE4BPDE4CPDE4DCDK1 | |
| SCHEMBL29241588 | 0.75 | PDE4A (0.50) | PDE4APDE4BPDE4CPDE4DCDK1 | |
| Adenine SCHEMBL7891002 | 0.73 | PI4KA (0.56) | PDE4APDE4BPDE4CPDE4DCDK1 | |
| SCHEMBL28141587 | 0.72 | DPP4 (0.42) | CDK2CYP1A2CYP2C19MGMTALDH1A1 |
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-2024030000-A1 | NOVEL COMPOUND AS HYPOXIA-INDUCIBLE FACTOR 1(HIF-1) INHIBITOR OR VASCULAR ENDOTHELIAL GROWTH FACTOR (VEGF) INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | 주식회사 넥스트젠바이오사이언스 | 2024-02-08 | — | — | WO | disclosed |