Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 4/20 | 0.54 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.54 |
| ▸ | PARP1 | P09874 | 2/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 10/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 10/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | TTK | P33981 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7711311 | 0.85 | CYP11B1 (0.48) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL7001705 | 0.84 | PARP1 (0.64) | PDE3BPDE3APARP1KDR | |
| SCHEMBL20137948 | 0.79 | CYP11B2 (0.41) | PDE3BPDE3APARP1CYP11B1CYP11B2 | |
| SCHEMBL6992017 | 0.76 | PARP1 (0.75) | PDE3BPDE3APARP1CYP1A2MAPT | |
| SCHEMBL21722859 | 0.76 | PARP1 (0.60) | PDE3BPDE3APARP1MAPTTSHR | |
| SCHEMBL532007 | 0.76 | KDR (0.53) | PDE3BPDE3APARP1MAPTKDR | |
| SCHEMBL6992024 | 0.76 | PARP1 (0.44) | PDE3BPDE3APARP1MAPTTSHR | |
| SCHEMBL532908 | 0.76 | PARP1 (0.55) | PDE3BPDE3APARP1MAPTTSHR | |
| SCHEMBL532744 | 0.75 | KDR (0.52) | PDE3BPDE3APARP1KDR | |
| SCHEMBL6992019 | 0.75 | PARP1 (0.51) | PDE3BPDE3APARP1MAPTTSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1015437-B1 | BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS | SCHERING AG (DE) | 2003-12-03 | — | — | EP | disclosed |
| US-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |