Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 4/20 | 0.40 |
| ▸ | USP8 | P40818 | 1/20 | 0.39 |
| ▸ | USP7 | Q93009 | 1/20 | 0.39 |
| ▸ | USP47 | Q96K76 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | KHK | P50053 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 6/20 | 0.37 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.37 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.37 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.37 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2653145 | 0.88 | CNR1 (0.41) | CYP11B2USP8USP7USP47GABRA1 | |
| SCHEMBL21283227 | 0.74 | MEN1 (0.46) | CYP11B2CYP11B1CNR1CNR2ALDH1A1 | |
| SCHEMBL21131569 | 0.74 | TRPV4 (0.45) | CYP11B2USP8USP7USP47CYP11B1 | |
| SCHEMBL9849412 | 0.73 | ADORA1 (0.49) | CYP11B2CYP11B1GABRG2GABRB3GABRA5 | |
| SCHEMBL6069435 | 0.70 | CNR1 (0.47) | CYP11B2CNR1CNR2ALDH1A1HPGD | |
| SCHEMBL31575181 | 0.69 | CYP11B2 (0.41) | CYP11B2CYP11B1KHKKCNQ3KCNQ2 | |
| SCHEMBL31416799 | 0.69 | CYP11B2 (0.42) | CYP11B2CYP11B1KHKKCNQ3KCNQ2 | |
| SCHEMBL29311545 | 0.69 | CYP11B2 (0.42) | CYP11B2CYP11B1KHKKCNQ3KCNQ2 | |
| SCHEMBL24084271 | 0.69 | AR (0.42) | CYP11B2USP8USP7USP47CYP11B1 | |
| SCHEMBL24084272 | 0.69 | CYP11B2 (0.38) | CYP11B2CYP11B1GABRA1GABRG2GABRB3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004065388-A1 | FLUOROIMIDAZOPYRIMIDINES AS GABA-A ALPHA 2/3 LIGANDS FOR DEPRESSION/ANXIETY | MERCK SHARP & DOHME LIMITED (GB) | 2004-08-05 | — | — | WO | disclosed |