Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.64 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.64 |
| ▸ | PGR | P06401 | 5/20 | 0.63 |
| ▸ | AHR | P35869 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.56 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.56 |
| ▸ | GRIA1 | P42261 | 4/20 | 0.55 |
| ▸ | CACNG8 | Q8WXS5 | 3/20 | 0.55 |
| ▸ | TDP2 | O95551 | 3/20 | 0.51 |
| ▸ | KIF11 | P52732 | 1/20 | 0.51 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.49 |
| ▸ | FEN1 | P39748 | 1/20 | 0.49 |
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.47 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.46 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1897593 | 0.86 | PDE3B (0.68) | PDE3BPDE3APGRAHRCYP1A2 | |
| SCHEMBL1908017 | 0.86 | GRIA1 (0.62) | PDE3BPDE3APGRAHRCYP1A2 | |
| SCHEMBL1896888 | 0.86 | TDP2 (0.70) | PDE3BPDE3APGRAHRCYP1A2 | |
| SCHEMBL1899619 | 0.83 | PDE3B (0.56) | PDE3BPDE3APGRAHRCYP1A2 | |
| SCHEMBL1900155 | 0.83 | AHR (0.77) | PDE3BPDE3APGRAHRCYP1A2 | |
| SCHEMBL18189405 | 0.82 | GRIA1 (0.70) | PDE3BPDE3APGRAHRCYP1A2 | |
| SCHEMBL1902333 | 0.82 | TDP2 (0.50) | PDE3BPDE3APGRCYP1A2CYP11B1 | |
| SCHEMBL3132725 | 0.81 | PGR (0.73) | PDE3BPDE3APGRAHRCYP1A2 | |
| SCHEMBL1900363 | 0.81 | PGR (0.68) | PDE3BPDE3APGRAHRCYP1A2 | |
| SCHEMBL24884440 | 0.80 | GRIA1 (0.69) | PDE3BPDE3APGRAHRCYP1A2 |
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-2011056985-A2 | SUBSTITUTED HETEROCYCLIC COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2011-05-12 | — | — | WO | disclosed |