Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRS3 | P32247 | 4/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | NMBR | P28336 | 1/20 | 0.44 |
| ▸ | GRPR | P30550 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21290207 | 0.97 | BRS3 (0.44) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL23487554 | 0.94 | FFAR1 (0.45) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL29306772 | 0.93 | GRM5 (0.41) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL26550027 | 0.91 | FFAR1 (0.44) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL14268241 | 0.90 | BRS3 (0.50) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL21290071 | 0.89 | FFAR1 (0.43) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL21290404 | 0.89 | FFAR1 (0.43) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL25100883 | 0.89 | HCAR2 (0.41) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL21290093 | 0.89 | TGFBR1 (0.44) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL21289814 | 0.89 | CYP11B1 (0.46) | BRS3NR1I2NMBRGRPRKCNH2 |
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 |