Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 1/20 | 0.37 |
| ▸ | GSR | P00390 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8539752 | 0.83 | CETP (0.30) | CETP | |
| SCHEMBL8180450 | 0.80 | CYP2D6 (0.39) | CETP | |
| SCHEMBL18923209 | 0.80 | CYP2D6 (0.39) | CETP | |
| SCHEMBL8180448 | 0.80 | CYP2D6 (0.39) | CETP | |
| SCHEMBL20099457 | 0.77 | TRPV1 (0.34) | GSRTRPV1TRPA1 | |
| SCHEMBL8059001 | 0.77 | SPHK1 (0.32) | CETP | |
| SCHEMBL9216238 | 0.73 | GSR (0.40) | GSRTRPV1TRPA1 | |
| SCHEMBL12321638 | 0.72 | — | — | |
| SCHEMBL5807580 | 0.71 | GRIK1 (0.46) | — | |
| SCHEMBL771021 | 0.71 | NFKB1 (0.43) | GSR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5563156-A | ANTICOAGULANTS, ANTIASTHMA AGENTS | MERRELL PHARMACEUTICALS INC. (US) | 1996-10-08 | — | — | US | disclosed |
| US-5498779-A | ANTICOAGULANTS AND TREATMENT OF ASTHMA | MERRELL PHARMACEUTICALS INC. (US) | 1996-03-12 | — | — | US | disclosed |
| US-5391705-A | Anticoagulants, treats thrombophlebitis, coronary thrombosis and asthma | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-02-21 | — | — | US | disclosed |
| EP-0503203-A1 | Novel thrombin inhibitors | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-09-16 | — | — | EP | disclosed |
| EP-0504064-A1 | Novel thrombin inhibitors | MERRELL PHARMACEUTICALS INC. (US) | 1992-09-16 | — | — | EP | disclosed |