Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 11/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 9/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.43 |
| ▸ | RAD51 | Q06609 | 2/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 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 | |
|---|---|---|---|---|
| SCHEMBL458763 | 0.82 | CYP11B2 (0.43) | CYP11B2CYP11B1USP2HTTNCOA1 | |
| SCHEMBL10175607 | 0.80 | CYP11B2 (0.49) | CYP11B2CYP11B1USP2HTTNCOA1 | |
| SCHEMBL10175604 | 0.80 | CYP11B2 (0.43) | CYP11B2CYP11B1USP2HTTNCOA1 | |
| SCHEMBL17896745 | 0.79 | PTGS2 (0.51) | CYP11B2CYP11B1USP2HTTNCOA1 | |
| SCHEMBL17896750 | 0.78 | CYP11B2 (0.43) | CYP11B2CYP11B1USP2HTTNCOA1 | |
| SCHEMBL17897056 | 0.75 | MET (0.49) | CYP11B2CYP11B1USP2HTTNCOA1 | |
| SCHEMBL17896753 | 0.72 | CYP11B2 (0.50) | CYP11B2CYP11B1KDM4EGAA | |
| SCHEMBL12325780 | 0.68 | RAB9A (0.54) | CYP11B2CYP11B1ALDH1A1MAPT | |
| SCHEMBL10176218 | 0.67 | CYP11B2 (0.60) | CYP11B2CYP11B1USP2HTTNCOA1 | |
| SCHEMBL10175606 | 0.67 | CYP11B2 (0.60) | CYP11B2CYP11B1USP2HTTNCOA1 |
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 5 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 |
| US-9382226-B2 | Aldosterone synthase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2016-07-05 | — | — | US | disclosed |
| EP-2595482-A1 | ALDOSTERONE SYNTHASE INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2013-05-29 | — | — | EP | disclosed |
| WO-2012012478-A1 | ALDOSTERONE SYNTHASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-01-26 | — | — | WO | disclosed |
| WO-2012012478-A1 | ALDOSTERONE SYNTHASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-01-26 | — | — | WO | disclosed |