Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | BRS3 | P32247 | 4/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | NMBR | P28336 | 1/20 | 0.38 |
| ▸ | GRPR | P30550 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 2/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 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 | |
|---|---|---|---|---|
| SCHEMBL21290196 | 0.89 | BRS3 (0.44) | HCAR2FFAR1BRS3NR1I2NMBR | |
| SCHEMBL23956249 | 0.87 | NPC1 (0.45) | NPC1RAB9ARETPDK2KDM1A | |
| SCHEMBL21290207 | 0.87 | BRS3 (0.44) | HCAR2FFAR1BRS3NR1I2NMBR | |
| SCHEMBL29306772 | 0.86 | GRM5 (0.41) | HCAR2FFAR1BRS3NR1I2NMBR | |
| SCHEMBL21290093 | 0.85 | TGFBR1 (0.44) | HCAR2FFAR1BRS3NR1I2NMBR | |
| SCHEMBL23487554 | 0.84 | FFAR1 (0.45) | HCAR2FFAR1BRS3NR1I2NMBR | |
| SCHEMBL21289752 | 0.84 | PDK2 (0.42) | HCAR2FFAR1BRS3NR1I2NMBR | |
| SCHEMBL21290226 | 0.83 | TGFBR1 (0.43) | HCAR2FFAR1BRS3NR1I2NMBR | |
| SCHEMBL21289816 | 0.82 | TGFBR1 (0.44) | HCAR2FFAR1BRS3NR1I2NMBR | |
| SCHEMBL21290195 | 0.82 | BRS3 (0.40) | HCAR2FFAR1BRS3NR1I2NMBR |
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 |