Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.61 |
| ▸ | GCK | P35557 | 12/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2646917 | 0.90 | KCNH2 (0.66) | KCNH2GCKKDM4ES1PR1S1PR3 | |
| SCHEMBL2658475 | 0.90 | KCNH2 (0.66) | KCNH2GCKKDM4ES1PR1S1PR3 | |
| SCHEMBL2647063 | 0.89 | KCNH2 (0.63) | KCNH2GCKKDM4ES1PR1S1PR3 | |
| SCHEMBL2658202 | 0.89 | KCNH2 (0.63) | KCNH2GCKKDM4ES1PR1S1PR3 | |
| SCHEMBL2663029 | 0.89 | KCNH2 (0.78) | KCNH2GCK | |
| SCHEMBL2645510 | 0.87 | KCNH2 (0.79) | KCNH2GCKKDM4ES1PR1S1PR3 | |
| SCHEMBL2646364 | 0.87 | KCNH2 (0.79) | KCNH2GCKKDM4ES1PR1S1PR3 | |
| SCHEMBL2662840 | 0.87 | KCNH2 (0.70) | KCNH2GCKKDM4ES1PR1S1PR3 | |
| SCHEMBL2646537 | 0.87 | KCNH2 (0.70) | KCNH2GCKKDM4ES1PR1S1PR3 | |
| SCHEMBL2646456 | 0.85 | KCNH2 (0.60) | KCNH2GCKKDM4ES1PR1S1PR3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6610846-B1 | Increase insulin secretion; type II diabetes; 2,3-Di-substituted N-heteroaromatic propionamides with 3- a phenyl group and 2- a methyl cycloalkyl ring; 3-cyclopentyl-2-(3,4-dichlorophenyl)-N-pyridazin-3-yl-propionamide | HOFFMAN-LA ROCHE INC. | 2003-08-26 | — | — | US | disclosed |