Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.43 |
| ▸ | CDK2 | P24941 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 4/20 | 0.41 |
| ▸ | PPARA | Q07869 | 4/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | IDE | P14735 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1773229 | 0.90 | CYP2C19 (0.51) | CYP2C19PTGDR2CCNE1CDK2RECQL | |
| SCHEMBL27681189 | 0.85 | CYP2C19 (0.52) | CYP2C19PTGDR2CCNE1CDK2PPARG | |
| SCHEMBL30337641 | 0.81 | CYP2C19 (0.56) | CYP2C19PTGDR2CCNE1CDK2RECQL | |
| SCHEMBL1772416 | 0.81 | CYP2C19 (0.56) | CYP2C19PTGDR2CCNE1CDK2RECQL | |
| SCHEMBL2590156 | 0.77 | CYP2C19 (0.55) | CYP2C19PTGDR2CCNE1CDK2RECQL | |
| SCHEMBL1773438 | 0.77 | CYP2C19 (0.55) | CYP2C19PTGDR2CCNE1CDK2RECQL | |
| SCHEMBL30559878 | 0.77 | CYP2C19 (0.55) | CYP2C19PTGDR2CCNE1CDK2RECQL | |
| SCHEMBL28497684 | 0.77 | CYP2C19 (0.55) | CYP2C19PTGDR2CCNE1CDK2RECQL | |
| SCHEMBL23269048 | 0.76 | ATM (0.53) | CYP2C19PTGDR2CCNE1CDK2RECQL | |
| SCHEMBL8688896 | 0.76 | CYP2C19 (0.51) | CYP2C19PTGDR2CCNE1CDK2RECQL |
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-0497516-A1 | Substituted pyrrolo-fused 6-membered heterocycles as angiotensin II antagonists | MERCK & CO. INC. (US) | 1992-08-05 | — | — | EP | disclosed |
| US-5124335-A | Hypotensive agents, antiglaucoma agents | MERCK & CO., INC. (US) | 1992-06-23 | — | — | US | disclosed |