Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 9/20 | 0.59 |
| ▸ | DGAT1 | O75907 | 9/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.54 |
| ▸ | MGLL | Q99685 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4560928 | 0.93 | DGAT1 (0.54) | CHEK2DGAT1KCNH2ADORA2AMGLL | |
| SCHEMBL4538780 | 0.88 | DGAT1 (0.51) | CHEK2DGAT1KCNH2ADORA2ACYP2C9 | |
| SCHEMBL4560992 | 0.86 | DGAT1 (0.57) | CHEK2DGAT1KCNH2ADORA2AMGLL | |
| SCHEMBL4561989 | 0.85 | DGAT1 (0.56) | CHEK2DGAT1KCNH2ADORA2ACYP2C9 | |
| SCHEMBL6994712 | 0.85 | DGAT1 (0.54) | CHEK2DGAT1KCNH2ADORA2ACYP2C9 | |
| SCHEMBL4543095 | 0.84 | DGAT1 (0.53) | CHEK2DGAT1KCNH2ADORA2ACYP2C9 | |
| SCHEMBL4562539 | 0.84 | DGAT1 (0.54) | CHEK2DGAT1KCNH2ADORA2ACYP2C9 | |
| SCHEMBL6993769 | 0.83 | CHEK2 (0.53) | CHEK2DGAT1KCNH2ADORA2AMGLL | |
| SCHEMBL4562113 | 0.83 | DGAT1 (0.52) | DGAT1KCNH2ADORA2ACYP2C9 | |
| SCHEMBL4559775 | 0.82 | DGAT1 (0.49) | CHEK2DGAT1KCNH2ADORA2ACYP2C9 |
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-2012064569-A1 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-05-18 | — | — | WO | disclosed |