Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL2176774 | 0.89 | PIM1 (0.36) | PIM1PIM3 | |
| SCHEMBL27083001 | 0.78 | — | — | |
| SCHEMBL12492784 | 0.75 | PIM1 (0.57) | PIM1PIM3 | |
| SCHEMBL2175236 | 0.75 | — | — | |
| SCHEMBL2176239 | 0.74 | PIM1 (0.58) | PIM1PIM3 | |
| SCHEMBL11299291 | 0.72 | HTT (0.40) | PIM1 | |
| SCHEMBL14554064 | 0.70 | PIM1 (0.31) | PIM1 | |
| SCHEMBL14554041 | 0.69 | — | — | |
| SCHEMBL14485343 | 0.68 | — | — | |
| SCHEMBL27081681 | 0.67 | CSNK1E (0.37) | PIM1PIM3 |
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-2012098387-A1 | 6, 7-RING-FUSED TRIAZOLO [4, 3 - B] PYRIDAZINE DERIVATIVES AS PIM INHIBITORS | CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) | 2012-07-26 | — | — | WO | disclosed |