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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL4946552 | 0.93 | IKBKB (0.86) | IKBKBCHUK | |
| SCHEMBL14046386 | 0.86 | IKBKB (0.76) | IKBKBCHUK | |
| SCHEMBL4946558 | 0.84 | IKBKB (0.71) | IKBKBCHUK | |
| Hydrochloric Acid SCHEMBL5742086 | 0.78 | IKBKB (0.76) | IKBKBCHUK | |
| SCHEMBL14028234 | 0.78 | IKBKB (1.00) | IKBKBCHUK | |
| Hydrochloric Acid SCHEMBL4945830 | 0.78 | IKBKB (0.98) | IKBKBCHUK | |
| Hydrochloric Acid SCHEMBL27601430 | 0.76 | IKBKB (0.61) | IKBKBCHUK | |
| SCHEMBL7105018 | 0.72 | IKBKB (0.88) | IKBKBCHUK | |
| SCHEMBL14491936 | 0.71 | IKBKB (0.79) | IKBKBCHUK | |
| Hydrochloric Acid SCHEMBL5743268 | 0.71 | IKBKB (0.63) | IKBKBCHUK |
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 |
|---|---|---|---|---|---|---|---|
| US-7435743-B2 | Pyridine derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 2008-10-14 | — | — | US | disclosed |
| US-7232909-B2 | Pyridine derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 2007-06-19 | — | — | US | disclosed |