Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 9/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 9/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | BRS3 | P32247 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25100532 | 1.00 | CYP11B1 (0.42) | CYP11B1CYP11B2CYP3A4BRS3MEN1 | |
| SCHEMBL25100976 | 0.93 | CYP11B1 (0.42) | CYP11B1CYP11B2CYP3A4BRS3MEN1 | |
| SCHEMBL25100598 | 0.91 | CYP11B1 (0.42) | CYP11B1CYP11B2CYP3A4BRS3MEN1 | |
| SCHEMBL25100534 | 0.91 | CYP11B1 (0.38) | CYP11B1CYP11B2CYP3A4BRS3MEN1 | |
| SCHEMBL21290098 | 0.89 | CYP11B1 (0.48) | CYP11B1CYP11B2CYP3A4BRS3PDCD1 | |
| SCHEMBL25100599 | 0.89 | CYP11B1 (0.48) | CYP11B1CYP11B2CYP3A4BRS3PDCD1 | |
| SCHEMBL25100830 | 0.88 | CYP11B1 (0.38) | CYP11B1CYP11B2CYP3A4BRS3MEN1 | |
| SCHEMBL25100932 | 0.87 | CYP11B1 (0.47) | CYP11B1CYP11B2CYP3A4PDCD1CD274 | |
| SCHEMBL21290225 | 0.86 | CYP11B1 (0.38) | CYP11B1CYP11B2CYP3A4BRS3MEN1 | |
| SCHEMBL21290350 | 0.85 | CYP11B1 (0.44) | CYP11B1CYP11B2CYP3A4PDCD1CD274 |
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 |