Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 4/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.36 |
| ▸ | BRS3 | P32247 | 3/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | NMBR | P28336 | 1/20 | 0.36 |
| ▸ | GRPR | P30550 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 2/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | WNT3A | P56704 | 1/20 | 0.35 |
| ▸ | GUSB | P08236 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL25100917 | 0.95 | CYP11B1 (0.36) | BRS3MAPTMEN1KMT2AGAA | |
| SCHEMBL21290345 | 0.92 | HCRTR1 (0.41) | HCRTR1HCRTR2BRS3NR1I2NMBR | |
| SCHEMBL21289785 | 0.89 | HCRTR1 (0.39) | HCRTR1HCRTR2BRS3NR1I2NMBR | |
| SCHEMBL23956228 | 0.89 | SYK (0.40) | SYKERN1GUSBALDH1A1MAPT | |
| SCHEMBL25100909 | 0.88 | BRS3 (0.37) | HCRTR1HCRTR2BRS3NR1I2NMBR | |
| SCHEMBL25100939 | 0.87 | WNT3A (0.39) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL25100830 | 0.86 | CYP11B1 (0.38) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL25100802 | 0.85 | BRS3 (0.35) | BRS3NR1I2NMBRGRPRKCNH2 | |
| SCHEMBL25100922 | 0.85 | ABL1 (0.36) | HCRTR1HCRTR2BRS3SYKALDH1A1 | |
| SCHEMBL25100778 | 0.85 | NPC1 (0.50) | HCRTR1HCRTR2ERN1ALDH1A1MAPT |
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 |