Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 5/20 | 0.61 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 4/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL463351 | 0.84 | CYP11B2 (0.67) | CYP11B2CYP11B1PDE10APTGS2PDE2A | |
| SCHEMBL17896714 | 0.83 | CYP11B2 (0.67) | CYP11B2CYP11B1L3MBTL1 | |
| SCHEMBL10175451 | 0.82 | CYP11B2 (0.63) | CYP11B2CYP11B1PDE10AS1PR1PDE2A | |
| SCHEMBL10175449 | 0.80 | CYP11B2 (0.60) | CYP11B2CYP11B1PDE10APDE2APDE7A | |
| SCHEMBL17896708 | 0.78 | CYP11B2 (0.68) | CYP11B2CYP11B1 | |
| SCHEMBL10175364 | 0.77 | L3MBTL1 (0.48) | CYP11B2CYP11B1L3MBTL1ALDH1A1HSD11B1 | |
| SCHEMBL10175118 | 0.77 | CYP11B2 (0.57) | CYP11B2CYP11B1PDE10APOLBSMN1; SMN2 | |
| SCHEMBL10175463 | 0.76 | CYP11B2 (0.67) | CYP11B2CYP11B1PDE10A | |
| SCHEMBL10175445 | 0.76 | CYP11B2 (1.00) | CYP11B2CYP11B1 | |
| SCHEMBL432410 | 0.75 | CYP11B2 (0.56) | CYP11B2CYP11B1L3MBTL1ALDH1A1HSD11B1 |
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 |
| US-9382226-B2 | Aldosterone synthase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2016-07-05 | — | — | US | disclosed |