Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Warfarin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VKORC1 known ✓ | Q9BQB6 | 2/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 8/20 | 0.69 |
| ▸ | ALB | P02768 | 2/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.69 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.69 |
| ▸ | MEN1 | O00255 | 1/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.69 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.56 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.56 |
| ▸ | NQO1 | P15559 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Warfarin SCHEMBL3792087 | 0.83 | CYP2C9 (1.00) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 | |
| Warfarin SCHEMBL4439794 | 0.83 | CYP2C9 (1.00) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 | |
| Warfarin SCHEMBL3689 | 0.83 | CYP2C9 (1.00) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 | |
| Warfarin SCHEMBL29400364 | 0.83 | CYP2C9 (1.00) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 | |
| Warfarin SCHEMBL2139452 | 0.83 | CYP2C9 (1.00) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 | |
| Warfarin SCHEMBL662875 | 0.83 | CYP2C9 (1.00) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 | |
| SCHEMBL27838892 | 0.82 | CYP2C9 (0.77) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 | |
| SCHEMBL17133407 | 0.82 | CYP2C9 (0.72) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 | |
| Warfarin SCHEMBL8332637 | 0.82 | CYP2C9 (0.97) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 | |
| Warfarin SCHEMBL13278154 | 0.82 | CYP2C9 (0.97) | CYP2C9ALBHSD17B10ALDH1A1VKORC1 |
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-2010110908-A2 | TRANSDERMAL VENOUS ACCESS LOCKING SOLUTION | Organic Medical Ventures, L.L.C. (US) | 2010-09-30 | — | — | WO | disclosed |