Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB2 | Q96IY4 | 17/20 | 0.62 |
| ▸ | CPA1 | P15085 | 1/20 | 0.57 |
| ▸ | CPB1 | P15086 | 5/20 | 0.54 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL7743896 | 0.88 | CPB2 (0.50) | CPB2CPA1CPB1DAOCYP19A1 | |
| SCHEMBL7743300 | 0.86 | CPB2 (0.48) | CPB2CPA1CPB1DAO | |
| SCHEMBL7053727 | 0.80 | CPA1 (0.71) | CPB2CPA1CPB1CYP19A1 | |
| Hydrochloric Acid SCHEMBL8495732 | 0.79 | CPA1 (0.69) | CPB2CPA1CPB1CYP19A1 | |
| SCHEMBL8865742 | 0.78 | CPA1 (0.76) | CPB2CPA1CPB1CYP19A1 | |
| SCHEMBL7704747 | 0.76 | CACNA1H (0.40) | CPB2DAOCYP19A1 | |
| Hydrochloric Acid SCHEMBL8763045 | 0.73 | CPA1 (0.71) | CPB2CPA1CPB1 | |
| SCHEMBL25220822 | 0.73 | TRPV4 (0.45) | DAO | |
| Hydrochloric Acid SCHEMBL8763128 | 0.73 | CPA1 (0.97) | CPB2CPA1CPB1 | |
| SCHEMBL2322118 | 0.72 | SLC7A5 (0.53) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1091736-A4 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO INC (US) | 2001-10-24 | — | — | EP | disclosed |
| EP-1091736-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 2001-04-18 | — | — | EP | disclosed |
| WO-2000001382-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2000-01-13 | — | — | WO | disclosed |