Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | CD38 | P28907 | 2/20 | 0.39 |
| ▸ | CTSA | P10619 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.34 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.34 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.34 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.34 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.34 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.34 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.34 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | ANPEP | P15144 | 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 | |
|---|---|---|---|---|
| SCHEMBL16973688 | 0.86 | CD38 (0.42) | GRM5CD38CNR1SMYD3PRKAB2 | |
| SCHEMBL16984569 | 0.81 | USP30 (0.48) | — | |
| SCHEMBL16973707 | 0.81 | DYRK1A (0.39) | GRM5CD38CTSAS1PR3PRKAB2 | |
| SCHEMBL16973778 | 0.81 | GRM5 (0.37) | GRM5CTSAS1PR3CHRM4 | |
| SCHEMBL22829189 | 0.80 | GRM5 (0.45) | GRM5CD38CTSAS1PR3CNR1 | |
| SCHEMBL22829190 | 0.80 | GRM5 (0.45) | GRM5CD38CTSAS1PR3CNR1 | |
| SCHEMBL19784084 | 0.80 | CNR1 (0.50) | GRM5CD38CNR1SMYD3 | |
| SCHEMBL16973764 | 0.79 | GRM5 (0.40) | GRM5CD38CTSAS1PR3CHRM4 | |
| SCHEMBL16973816 | 0.79 | SIRT6 (0.42) | GRM5CHRM4PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL16984511 | 0.78 | GRM5 (0.46) | GRM5CD38CTSAS1PR3CNR1 |
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-2015113927-A1 | AMINO-SUBSTITUTED ISOTHIAZOLES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2015-08-06 | — | — | WO | disclosed |