Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRS3 | P32247 | 5/20 | 0.35 |
| ▸ | WNT3A | P56704 | 5/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | NMBR | P28336 | 1/20 | 0.34 |
| ▸ | GRPR | P30550 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | EDNRB | P24530 | 1/20 | 0.32 |
| ▸ | EDNRA | P25101 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 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 | |
|---|---|---|---|---|
| SCHEMBL25100897 | 0.96 | PTGS2 (0.33) | BRS3PTGS2CHRM5 | |
| SCHEMBL21290352 | 0.92 | PDK2 (0.39) | BRS3WNT3APDK2FFAR1NR1I2 | |
| SCHEMBL25100807 | 0.91 | WNT3A (0.35) | BRS3WNT3APDK2FFAR1NR1I2 | |
| SCHEMBL23956167 | 0.90 | PDK2 (0.38) | WNT3APDK2ALOX5APPTGS1EDNRB | |
| SCHEMBL25100801 | 0.89 | CCR6 (0.33) | BRS3WNT3APDK2FFAR1NR1I2 | |
| SCHEMBL25100902 | 0.87 | ABL1 (0.33) | BRS3WNT3AFFAR1 | |
| SCHEMBL25100510 | 0.86 | NPC1 (0.35) | BRS3WNT3APDK2FFAR1CA12 | |
| SCHEMBL25100506 | 0.86 | BRS3 (0.33) | BRS3WNT3APDK2FFAR1NR1I2 | |
| SCHEMBL23956253 | 0.86 | PTGS2 (0.39) | ALOX5APPTGS2 | |
| SCHEMBL25100560 | 0.85 | HCRTR1 (0.36) | BRS3WNT3AFFAR1NR1I2NMBR |
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-3752512-B1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2023-03-01 | — | — | EP | disclosed |