Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ6 | P48051 | 6/20 | 0.39 |
| ▸ | KCNJ5 | P48544 | 6/20 | 0.39 |
| ▸ | KCNJ3 | P48549 | 6/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.31 |
| ▸ | MTOR | P42345 | 5/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25004868 | 0.86 | PDE10A (0.33) | CYP17A1CYP1A2PDE2A | |
| SCHEMBL23995384 | 0.85 | CYP17A1 (0.33) | CYP17A1CYP1A2PDE2A | |
| SCHEMBL25589575 | 0.83 | KCNJ6 (0.34) | KCNJ6KCNJ5KCNJ3CYP17A1CYP1A2 | |
| SCHEMBL25270071 | 0.81 | FFAR1 (0.35) | KCNJ6KCNJ5KCNJ3PIK3CAMTOR | |
| SCHEMBL25590352 | 0.81 | FFAR1 (0.35) | KCNJ6KCNJ5KCNJ3PIK3CAMTOR | |
| SCHEMBL30224195 | 0.79 | — | — | |
| SCHEMBL30181794 | 0.79 | — | — | |
| SCHEMBL25005876 | 0.79 | — | — | |
| SCHEMBL23994591 | 0.79 | — | — | |
| SCHEMBL30393922 | 0.78 | MAPT (0.35) | KCNJ6KCNJ5KCNJ3CYP17A1CYP1A2 |
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-2021222522-A1 | CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2021-11-04 | — | — | WO | disclosed |