Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRS3 | P32247 | 7/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | NMBR | P28336 | 1/20 | 0.40 |
| ▸ | GRPR | P30550 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | WNT3A | P56704 | 4/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | EDNRB | P24530 | 1/20 | 0.35 |
| ▸ | EDNRA | P25101 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21290192 | 0.89 | BRS3 (0.38) | BRS3 | |
| SCHEMBL23956160 | 0.88 | TGFBR1 (0.41) | TGFBR1EDNRBEDNRACYP1A2CYP2D6 | |
| SCHEMBL25100526 | 0.88 | BRS3 (0.38) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL21289929 | 0.85 | BRS3 (0.39) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL21289765 | 0.84 | PDK1 (0.40) | BRS3FFAR4EDNRA | |
| SCHEMBL21290196 | 0.84 | BRS3 (0.44) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL25100883 | 0.82 | HCAR2 (0.41) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL25100578 | 0.82 | BRS3 (0.44) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL21290398 | 0.82 | BRS3 (0.34) | BRS3FFAR4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL25100939 | 0.82 | WNT3A (0.39) | 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 |