Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGKZ | Q13574 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.40 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.39 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 2/20 | 0.38 |
| ▸ | CDK8 | P49336 | 2/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15324898 | 0.81 | TLR7 (0.43) | DGKZJAK2JAK1TLR7PDE1B | |
| SCHEMBL1929059 | 0.81 | JAK2 (0.43) | DGKZJAK2JAK1TLR7PDE1B | |
| SCHEMBL15312373 | 0.81 | TLR7 (0.45) | DGKZJAK2JAK1TLR7PDE1B | |
| SCHEMBL22425610 | 0.81 | TLR7 (0.43) | DGKZJAK2JAK1TLR7PDE1B | |
| SCHEMBL9953021 | 0.75 | KCNJ1 (0.45) | JAK2JAK1KCNJ1KCNH2PDE1B | |
| SCHEMBL14857044 | 0.75 | SIRT2 (0.41) | CYP19A1TSHRSMN1; SMN2 | |
| SCHEMBL15312545 | 0.74 | CYP51A1 (0.40) | DGKZJAK2JAK1TLR7PDE1B | |
| SCHEMBL25153282 | 0.72 | LPL (0.43) | DGKZJAK2JAK1TLR7PDE1B | |
| SCHEMBL11145753 | 0.70 | CYP19A1 (0.47) | CYP19A1KCNJ1KCNH2CCR2CYP11B1 | |
| SCHEMBL13162684 | 0.68 | CCNC (0.41) | DGKZJAK2JAK1TLR7PDE1B |
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-2579717-A2 | POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 | Merck Sharp & Dohme Corp. (US) | 2013-04-17 | — | — | EP | claimed |
| WO-2011156245-A2 | POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 | MERCK SHARP & DOHME CORP. (US) | 2011-12-15 | — | — | WO | claimed |