Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 11/20 | 0.53 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.48 |
| ▸ | PDE2A | O00408 | 6/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL460559 | 0.81 | CYP11B2 (0.46) | PDE10ACYP11B2CYP11B1PDE2A | |
| SCHEMBL17883780 | 0.81 | CYP11B2 (0.68) | CYP11B2CYP11B1CYP17A1CYP1A2 | |
| SCHEMBL463351 | 0.80 | CYP11B2 (0.67) | PDE10ACYP11B2CYP11B1PDE2ACYP17A1 | |
| SCHEMBL17896700 | 0.78 | CYP11B2 (0.62) | CYP11B2CYP11B1 | |
| SCHEMBL17896602 | 0.78 | CYP11B2 (0.67) | PDE10ACYP11B2CYP11B1PDE2APOLB | |
| SCHEMBL432104 | 0.77 | PDE10A (0.65) | PDE10ACYP11B2CYP11B1PDE2ATDO2 | |
| SCHEMBL17896600 | 0.73 | CYP11B2 (0.45) | CYP11B2CYP11B1CYP1A2 | |
| SCHEMBL17896702 | 0.72 | CYP11B2 (0.41) | PDE10ACYP11B2CYP11B1PDE2ATDO2 | |
| SCHEMBL17896699 | 0.70 | PTGS2 (0.39) | CYP11B2CYP11B1PTGS2 | |
| SCHEMBL461417 | 0.69 | PDE10A (0.46) | PDE10ACYP11B2CYP11B1PDE2ACYP17A1 |
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 |