Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 10/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 5/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | KIT | P10721 | 1/20 | 0.30 |
| ▸ | PDGFRA | P16234 | 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 | |
|---|---|---|---|---|
| SCHEMBL17896604 | 0.81 | PDE10A (0.53) | CYP11B2CYP11B1PDE10APDE2A | |
| SCHEMBL17883780 | 0.80 | CYP11B2 (0.68) | CYP11B2CYP11B1CYP3A4CYP19A1 | |
| SCHEMBL460971 | 0.80 | CYP11B2 (0.66) | CYP11B2CYP11B1CYP3A4CYP19A1 | |
| SCHEMBL17896600 | 0.78 | CYP11B2 (0.45) | CYP11B2CYP11B1CYP3A4CYP19A1 | |
| SCHEMBL17896702 | 0.77 | CYP11B2 (0.41) | CYP11B2CYP11B1CYP19A1PDE10APDE2A | |
| SCHEMBL17896708 | 0.77 | CYP11B2 (0.68) | CYP11B2CYP11B1CYP3A4CYP19A1SSTR5 | |
| SCHEMBL17896699 | 0.75 | PTGS2 (0.39) | CYP11B2CYP11B1CYP19A1 | |
| SCHEMBL17896703 | 0.73 | CYP11B1 (0.50) | CYP11B2CYP11B1CYP3A4PDE10APDE2A | |
| SCHEMBL429041 | 0.72 | MEN1 (0.51) | CYP11B2CYP11B1CYP3A4 | |
| SCHEMBL17896700 | 0.72 | CYP11B2 (0.62) | CYP11B2CYP11B1 |
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 4 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 |
| US-9382226-B2 | Aldosterone synthase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2016-07-05 | — | — | US | disclosed |
| US-9382226-B2 | Aldosterone synthase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2016-07-05 | — | — | US | disclosed |