Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 13/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 13/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | WNT3A | P56704 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.35 |
| ▸ | SGK1 | O00141 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL21290350 | 1.00 | CYP11B1 (0.44) | CYP11B1CYP11B2CYP3A4PDCD1CD274 | |
| SCHEMBL21290097 | 0.95 | CYP11B1 (0.46) | CYP11B1CYP11B2CYP3A4PDCD1CD274 | |
| SCHEMBL25100599 | 0.95 | CYP11B1 (0.48) | CYP11B1CYP11B2CYP3A4PDCD1CD274 | |
| SCHEMBL21290098 | 0.95 | CYP11B1 (0.48) | CYP11B1CYP11B2CYP3A4PDCD1CD274 | |
| SCHEMBL25100932 | 0.93 | CYP11B1 (0.47) | CYP11B1CYP11B2CYP3A4PDCD1CD274 | |
| SCHEMBL21290202 | 0.90 | CYP11B1 (0.48) | CYP11B1CYP11B2CYP3A4PDCD1CD274 | |
| SCHEMBL25100963 | 0.90 | CYP11B1 (0.44) | CYP11B1CYP11B2CYP3A4NPC1RAB9A | |
| SCHEMBL21290329 | 0.90 | CYP11B1 (0.43) | CYP11B1CYP11B2CYP3A4PDCD1CD274 | |
| SCHEMBL25100908 | 0.89 | HSD17B1 (0.45) | CYP11B1CYP11B2PDCD1CD274NPC1 | |
| SCHEMBL24291906 | 0.88 | CYP11B1 (0.39) | 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 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 |