Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Ethyl Biscoumacetate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VKORC1 known ✓ | Q9BQB6 | 4/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.76 |
| ▸ | NQO1 | P15559 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALB | P02768 | 1/20 | 0.48 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Ethyl Biscoumacetate SCHEMBL29359768 | 0.87 | ADORA3 (1.00) | ADORA3NQO1CYP2C9ALDH1A1VKORC1 | |
| Ethyl Biscoumacetate SCHEMBL42830 | 0.87 | ADORA3 (1.00) | ADORA3NQO1CYP2C9ALDH1A1VKORC1 | |
| Phenprocoumon SCHEMBL3828265 | 0.83 | CYP2C9 (0.76) | NQO1CYP2C9ALDH1A1VKORC1KDM4E | |
| SCHEMBL5107024 | 0.82 | ADORA3 (0.86) | ADORA3NQO1CYP2C9ALDH1A1VKORC1 | |
| Dicumarol SCHEMBL28086433 | 0.77 | NQO1 (0.71) | NQO1CYP2C9ALDH1A1VKORC1PCSK7 | |
| Warfarin SCHEMBL2762070 | 0.76 | CYP2C9 (0.69) | NQO1CYP2C9ALDH1A1VKORC1KDM4E | |
| SCHEMBL1647635 | 0.76 | ADORA3 (0.77) | ADORA3NQO1CYP2C9ALDH1A1VKORC1 | |
| SCHEMBL5106117 | 0.74 | ADORA3 (0.70) | ADORA3NQO1CYP2C9ALDH1A1VKORC1 | |
| SCHEMBL14078678 | 0.74 | ADORA3 (0.70) | ADORA3NQO1CYP2C9ALDH1A1VKORC1 | |
| SCHEMBL23044113 | 0.73 | ADORA3 (0.59) | ADORA3NQO1CYP2C9ALDH1A1VKORC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2323627-A1 | NOVEL RAPID-EFFECT PHARMACEUTICAL FORMS AND USES OF RESULTING PHARMACEUTICAL COMPOSITIONS | Bionetwork (FR) | 2011-05-25 | — | — | EP | disclosed |
| WO-2010007232-A9 | NOVEL RAPID-EFFECT PHARMACEUTICAL FORMS AND USES OF RESULTING PHARMACEUTICAL COMPOSITIONS | BIONETWORK (FR) | 2010-03-11 | — | — | WO | disclosed |
| WO-2010007232-A1 | NOVEL RAPID-EFFECT PHARMACEUTICAL FORMS AND USES OF RESULTING PHARMACEUTICAL COMPOSITIONS | BIONETWORK (FR) | 2010-01-21 | — | — | WO | disclosed |
| WO-1997004749-A1 | METHOD FOR PREPARING DRY PHARMACEUTICAL FORMS, AND RESULTING PHARMACEUTICAL COMPOSITIONS | LABORATOIRES EFFIK (FR) | 1997-02-13 | — | — | WO | disclosed |