Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 10/20 | 0.56 |
| ▸ | CYP11B1 | P15538 | 8/20 | 0.40 |
| ▸ | NOS2 | P35228 | 2/20 | 0.38 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL460601 | 0.85 | CYP11B2 (0.67) | CYP11B2CYP11B1ERN1PRKCZ | |
| SCHEMBL17896589 | 0.80 | CYP11B2 (0.51) | CYP11B2CYP11B1HTR2CKDM4ERPS6KA5 | |
| SCHEMBL433566 | 0.79 | RPS6KA5 (0.49) | CYP11B2CYP11B1PTGER4HTR2CKDM4E | |
| SCHEMBL10175445 | 0.72 | CYP11B2 (1.00) | CYP11B2CYP11B1ERN1PRKCZ | |
| SCHEMBL17896650 | 0.70 | PTGER4 (0.43) | CYP11B2CYP11B1PTGER4KDM4EL3MBTL1 | |
| SCHEMBL17896768 | 0.70 | CYP11B2 (0.69) | CYP11B2CYP11B1NOS2ERN1NOS3 | |
| SCHEMBL461417 | 0.65 | PDE10A (0.46) | CYP11B2CYP11B1NOS2 | |
| SCHEMBL17883785 | 0.65 | KDM4E (0.49) | CYP11B2CYP11B1KDM4ERPS6KA5 | |
| SCHEMBL17896743 | 0.65 | CYP11B2 (0.60) | CYP11B2CYP11B1ERN1KDM4EMAPT | |
| SCHEMBL11077028 | 0.65 | NLRP3 (0.55) | PTGER4KDM4EMAPTL3MBTL1RPS6KA5 |
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 |