Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4756992 | 0.98 | HSD11B1 (0.42) | HSD11B1CYP1A2AKR1B1 | |
| SCHEMBL4085736 | 0.98 | HSD11B1 (0.42) | HSD11B1CYP1A2AKR1B1 | |
| Tert-Butylamine SCHEMBL4753887 | 0.90 | HSD11B1 (0.37) | HSD11B1CYP1A2AKR1B1 | |
| SCHEMBL4754114 | 0.79 | HSD11B1 (0.40) | HSD11B1CYP1A2 | |
| SCHEMBL4754117 | 0.79 | HSD11B1 (0.40) | HSD11B1CYP1A2 | |
| SCHEMBL4755383 | 0.78 | TSHR (0.34) | — | |
| SCHEMBL4756191 | 0.77 | HSD11B1 (0.38) | HSD11B1CYP1A2AKR1B1 | |
| SCHEMBL4756195 | 0.77 | HSD11B1 (0.38) | HSD11B1CYP1A2AKR1B1 | |
| SCHEMBL7552932 | 0.74 | — | — | |
| SCHEMBL3909670 | 0.72 | CYP2C19 (0.47) | HSD11B1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008155619-A2 | PREPARATION OF OPTICALLY-ACTIVE CYCLIC AMINO ACIDS | PFIZER INC. (US) | 2008-12-24 | — | — | WO | disclosed |