Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 9/20 | 0.52 |
| ▸ | CYP11B2 | P19099 | 9/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | PDE2A | O00408 | 5/20 | 0.46 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.46 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | ESRRA | P11474 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17896760 | 0.89 | CYP11B1 (0.52) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL460358 | 0.88 | RAB9A (0.48) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10175785 | 0.88 | CYP11B1 (0.63) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17896582 | 0.85 | PDE2A (0.46) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17896611 | 0.85 | CYP11B2 (0.50) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17896676 | 0.82 | CYP11B1 (0.68) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL462192 | 0.82 | CYP11B2 (0.49) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17883787 | 0.82 | CYP11B1 (0.48) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17896621 | 0.80 | SMN1; SMN2 (0.49) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17896664 | 0.80 | ALOX5AP (0.54) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-9382226-B2 | Aldosterone synthase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2016-07-05 | — | — | US | disclosed |
| WO-2012012478-A1 | ALDOSTERONE SYNTHASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-01-26 | — | — | WO | disclosed |