Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CKS1B | P61024 | 1/20 | 0.42 |
| ▸ | SKP1 | P63208 | 1/20 | 0.42 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 5/20 | 0.42 |
| ▸ | CA1 | P00915 | 5/20 | 0.42 |
| ▸ | CA2 | P00918 | 5/20 | 0.42 |
| ▸ | CA9 | Q16790 | 5/20 | 0.42 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9902057 | 0.80 | GRM5 (0.41) | CKS1BSKP1SKP2DRD2CA12 | |
| SCHEMBL9900973 | 0.80 | GRM5 (0.41) | CKS1BSKP1SKP2DRD2CA12 | |
| SCHEMBL17274051 | 0.79 | PDE10A (0.49) | CKS1BSKP1SKP2DRD2MALT1 | |
| SCHEMBL9900342 | 0.79 | GRM5 (0.40) | CKS1BSKP1SKP2DRD2CA12 | |
| SCHEMBL1632156 | 0.77 | NAMPT (0.44) | DRD2MALT1BCHE | |
| SCHEMBL9900560 | 0.77 | ADORA3 (0.41) | DRD2CA12CA1CA2CA9 | |
| SCHEMBL2661800 | 0.76 | DRD2 (0.43) | DRD2CA12CA1CA2CA9 | |
| SCHEMBL1632152 | 0.76 | DRD2 (0.43) | CKS1BSKP1SKP2DRD2CA12 | |
| SCHEMBL24265779 | 0.75 | GRM5 (0.43) | GRM5 | |
| SCHEMBL13011413 | 0.74 | DRD2 (0.41) | CKS1BSKP1SKP2DRD2CA12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2648723-A1 | BICYCLIC PYRAZOLE COMPOUNDS AS ALLOSTERIC MODULATORS OF MGLUR5 RECEPTORS | Vanderbilt University (US) | 2013-10-16 | — | — | EP | disclosed |
| WO-2012078817-A1 | BICYCLIC PYRAZOLE COMPOUNDS AS ALLOSTERIC MODULATORS OF MGLUR5 RECEPTORS | VANDERBILT UNIVERSITY (US) | 2012-06-14 | — | — | WO | disclosed |