Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 19/20 | 0.66 |
| ▸ | CYP11B1 | P15538 | 16/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL460559 | 0.80 | CYP11B2 (0.46) | CYP11B2CYP11B1CYP3A4CYP19A1 | |
| SCHEMBL10175441 | 0.80 | CYP11B2 (0.62) | CYP11B2CYP11B1CYP3A4CYP19A1 | |
| SCHEMBL17896601 | 0.80 | CYP11B2 (0.67) | CYP11B2CYP11B1CYP19A1ADRA2B | |
| SCHEMBL459367 | 0.80 | CYP11B2 (1.00) | CYP11B2CYP11B1CYP3A4CYP19A1ADRA2B | |
| SCHEMBL10175440 | 0.79 | CYP11B2 (0.76) | CYP11B2CYP11B1CYP3A4CYP19A1ADRA2B | |
| SCHEMBL463383 | 0.75 | CYP11B2 (0.69) | CYP11B2CYP11B1CYP19A1ADRA2B | |
| SCHEMBL17896731 | 0.75 | CYP11B1 (0.72) | CYP11B2CYP11B1CYP3A4CYP19A1ADRA2B | |
| SCHEMBL459223 | 0.74 | CYP11B2 (0.74) | CYP11B2CYP11B1CYP19A1ADRA2B | |
| SCHEMBL10175335 | 0.74 | CYP11B2 (0.53) | CYP11B2CYP11B1CYP19A1ADRA2B | |
| SCHEMBL17896591 | 0.73 | CYP11B2 (0.57) | CYP11B2CYP11B1CYP19A1ADRA2B |
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-2595482-A1 | ALDOSTERONE SYNTHASE INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2013-05-29 | — | — | EP | claimed |
| WO-2012012478-A1 | ALDOSTERONE SYNTHASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-01-26 | — | — | WO | claimed |