Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | GUCY1A1 | Q02108 | 16/20 | 0.48 |
| ▸ | GUCY1B1 | Q02153 | 16/20 | 0.48 |
| ▸ | GUCY1B2 | O75343 | 10/20 | 0.48 |
| ▸ | GUCY1A2 | P33402 | 10/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SLC16A3 | O15427 | 2/20 | 0.43 |
| ▸ | SLC16A1 | P53985 | 2/20 | 0.43 |
| ▸ | MCTS1 | Q9ULC4 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL19513159 | 0.92 | KCNH2 (0.47) | KCNH2ADORA3GUCY1A1GUCY1B1GUCY1B2 | |
| SCHEMBL3437467 | 0.91 | KCNH2 (0.61) | KCNH2ADORA3GUCY1A1GUCY1B1GUCY1B2 | |
| SCHEMBL19513351 | 0.82 | KCNH2 (0.43) | KCNH2ADORA3GUCY1A1GUCY1B1GUCY1B2 | |
| SCHEMBL3437513 | 0.81 | GUCY1B2 (0.47) | KCNH2ADORA3GUCY1A1GUCY1B1GUCY1B2 | |
| SCHEMBL3436841 | 0.81 | KCNH2 (0.56) | KCNH2ADORA3GUCY1A1GUCY1B1GUCY1B2 | |
| SCHEMBL19513325 | 0.80 | KCNH2 (0.51) | KCNH2ADORA3GUCY1A1GUCY1B1GUCY1B2 | |
| SCHEMBL3437446 | 0.79 | KCNH2 (0.65) | KCNH2ADORA3GUCY1A1GUCY1B1GUCY1B2 | |
| SCHEMBL21565226 | 0.79 | GUCY1B2 (0.47) | KCNH2ADORA3GUCY1A1GUCY1B1GUCY1B2 | |
| SCHEMBL16081967 | 0.78 | GUCY1B2 (0.63) | KCNH2ADORA3GUCY1A1GUCY1B1GUCY1B2 | |
| SCHEMBL23161938 | 0.78 | KCNH2 (0.63) | KCNH2ADORA3GUCY1A1GUCY1B1 |
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-2012003405-A1 | SGC STIMULATORS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2012-01-05 | — | — | WO | disclosed |