Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.42 |
| ▸ | BRS3 | P32247 | 4/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | NMBR | P28336 | 1/20 | 0.39 |
| ▸ | GRPR | P30550 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25100913 | 0.91 | PDK2 (0.37) | PDK2BRS3FFAR1HCAR2NR1I2 | |
| SCHEMBL25100939 | 0.90 | WNT3A (0.39) | PDK2BRS3FFAR1HCAR2NR1I2 | |
| SCHEMBL25100912 | 0.89 | PDK2 (0.38) | PDK2BRS3FFAR1HCAR2NR1I2 | |
| SCHEMBL25100916 | 0.89 | AR (0.42) | PDK2BRS3FFAR1HCAR2CA12 | |
| SCHEMBL25100884 | 0.88 | BRS3 (0.39) | PDK2BRS3FFAR1HCAR2NR1I2 | |
| SCHEMBL21290196 | 0.88 | BRS3 (0.44) | PDK2BRS3FFAR1HCAR2NR1I2 | |
| SCHEMBL26550027 | 0.87 | FFAR1 (0.44) | PDK2BRS3FFAR1HCAR2NR1I2 | |
| SCHEMBL21289804 | 0.87 | L3MBTL1 (0.41) | BRS3FFAR1HCAR2FAAHCES1 | |
| SCHEMBL21290404 | 0.86 | FFAR1 (0.43) | PDK2BRS3FFAR1HCAR2NR1I2 | |
| SCHEMBL21290071 | 0.86 | FFAR1 (0.43) | PDK2BRS3FFAR1HCAR2NR1I2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3752512-B1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2023-03-01 | — | — | EP | disclosed |
| WO-2019158453-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2019-08-22 | — | — | WO | disclosed |