Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 6/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | FNTA | P49354 | 3/20 | 0.35 |
| ▸ | FNTB | P49356 | 3/20 | 0.35 |
| ▸ | APLNR | P35414 | 6/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 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 | |
|---|---|---|---|---|
| SCHEMBL19763074 | 0.93 | CYP11B2 (0.43) | CYP11B2CYP11B1NR3C1NR3C2FNTA | |
| SCHEMBL1039260 | 0.88 | CYP11B2 (0.45) | CYP11B2CYP11B1NR3C1NR3C2FNTA | |
| SCHEMBL17894246 | 0.87 | CYP11B2 (0.39) | CYP11B2CYP11B1NR3C1NR3C2FNTA | |
| SCHEMBL17894240 | 0.86 | CYP11B2 (0.38) | CYP11B2CYP11B1NR3C1NR3C2FNTA | |
| SCHEMBL13563925 | 0.81 | CYP11B2 (0.45) | CYP11B2CYP11B1NR3C1NR3C2FNTA | |
| SCHEMBL3466250 | 0.80 | CYP11B2 (0.44) | CYP11B2CYP11B1NR3C2FNTAFNTB | |
| SCHEMBL17894300 | 0.77 | SLC6A9 (0.35) | CYP11B2CYP11B1FNTAFNTBAPLNR | |
| SCHEMBL1038484 | 0.76 | CYP11B2 (0.41) | CYP11B2CYP11B1NR3C1NR3C2FNTA | |
| SCHEMBL14562264 | 0.75 | CYP11B2 (0.40) | CYP11B2CYP11B1NR3C1NR3C2FNTA | |
| SCHEMBL3465184 | 0.75 | CYP11B1 (0.37) | CYP11B2CYP11B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016109361-A2 | 3-FLUORO-BENZONITRILE INHIBITORS OF 11-BETA-HYDROXYLASE | AUSPEX PHARMACEUTICALS, INC. (US) | 2016-07-07 | — | — | WO | disclosed |
| WO-2016109361-A2 | 3-FLUORO-BENZONITRILE INHIBITORS OF 11-BETA-HYDROXYLASE | AUSPEX PHARMACEUTICALS, INC. (US) | 2016-07-07 | — | — | WO | disclosed |