Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 3/20 | 0.33 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16719007 | 0.88 | MGAT2 (0.40) | CNR1MGAT2MEN1KMT2AGSK3B | |
| SCHEMBL16719012 | 0.80 | MGAT2 (0.40) | MGAT2MEN1KMT2AGSK3BDYRK1A | |
| SCHEMBL16718985 | 0.75 | MGAT2 (0.39) | CNR1MGAT2GSK3BDYRK1AKDM4E | |
| SCHEMBL16718991 | 0.73 | MGAT2 (0.38) | MGAT2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL16730869 | 0.69 | CYP11B1 (0.35) | HSP90AA1HSP90AB1MEN1KMT2AALDH1A1 | |
| SCHEMBL16730862 | 0.69 | CYP11B1 (0.45) | HSP90AA1HSP90AB1MEN1KMT2AGSK3B | |
| SCHEMBL16730866 | 0.69 | CYP11B1 (0.35) | HSP90AA1HSP90AB1MEN1KMT2AHPGD | |
| SCHEMBL16730940 | 0.67 | TSHR (0.35) | CNR1MGAT2ALDH1A1CYP1A2CYP11B1 | |
| SCHEMBL16718982 | 0.66 | MGAT2 (0.37) | MGAT2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL16731955 | 0.66 | SIGMAR1 (0.33) | MGAT2CYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3068391-B1 | ARYL LINKED IMIDAZOLE AND TRIAZOLE DERIVATIVES AND METHODS OF USE THEREOF FOR IMPROVING THE PHARMACOKINETICS OF A DRUG | MERCK SHARP & DOHME (US) | 2018-05-23 | — | — | EP | disclosed |