Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.45 |
| ▸ | VDR | P11473 | 3/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1039872 | 1.00 | CYP19A1 (0.45) | CYP19A1VDRHTT | |
| SCHEMBL12600213 | 1.00 | CYP19A1 (0.45) | CYP19A1VDRHTT | |
| SCHEMBL13243996 | 1.00 | CYP19A1 (0.45) | CYP19A1VDRHTT | |
| SCHEMBL14473784 | 0.86 | CYP19A1 (0.41) | CYP19A1VDR | |
| SCHEMBL8993014 | 0.82 | CYP19A1 (0.37) | CYP19A1VDR | |
| SCHEMBL8993016 | 0.82 | CYP19A1 (0.37) | CYP19A1VDR | |
| SCHEMBL8992727 | 0.80 | CYP19A1 (0.39) | CYP19A1VDR | |
| SCHEMBL8992724 | 0.80 | CYP19A1 (0.39) | CYP19A1VDR | |
| SCHEMBL8992723 | 0.79 | CYP19A1 (0.34) | CYP19A1 | |
| SCHEMBL8992719 | 0.79 | CYP19A1 (0.34) | CYP19A1 |
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-2751075-B1 | CRYSTALLIZATION OF 1 ALPHA-HYDROXY-20-METHYLENE-19,24,25,26,27-PENTANORVITAMIN D3 | WISCONSIN ALUMNI RES FOUND (US) | 2018-01-17 | — | — | EP | disclosed |