Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 15/20 | 0.67 |
| ▸ | CYP11B1 | P15538 | 11/20 | 0.67 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 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 | |
|---|---|---|---|---|
| SCHEMBL4243953 | 0.90 | CYP11B2 (0.69) | CYP11B2CYP11B1CYP17A1CYP19A1ATM | |
| SCHEMBL17896609 | 0.84 | CYP11B2 (0.48) | CYP11B2CYP11B1 | |
| SCHEMBL17897060 | 0.84 | MEN1 (0.57) | CYP11B2CYP11B1ATM | |
| SCHEMBL10175107 | 0.83 | CYP11B2 (0.47) | CYP11B2CYP11B1 | |
| SCHEMBL17896613 | 0.81 | CYP11B2 (0.46) | CYP11B2CYP11B1 | |
| SCHEMBL17896612 | 0.81 | CYP11B2 (0.52) | CYP11B2CYP11B1CYP19A1 | |
| SCHEMBL458680 | 0.81 | CYP11B2 (1.00) | CYP11B2CYP11B1 | |
| SCHEMBL8209154 | 0.80 | CYP11B2 (0.71) | CYP11B2CYP11B1ATMUSP2HTT | |
| SCHEMBL10176164 | 0.80 | CYP11B2 (1.00) | CYP11B2CYP11B1ATMUSP2HTT | |
| SCHEMBL17896686 | 0.80 | CYP11B2 (0.71) | CYP11B2CYP11B1ATMMAOAUSP2 |
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 |