Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.50 |
| ▸ | IKBKB | O14920 | 2/20 | 0.44 |
| ▸ | NPY1R | P25929 | 1/20 | 0.43 |
| ▸ | NPY2R | P49146 | 1/20 | 0.43 |
| ▸ | BCL6 | P41182 | 3/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL402011 | 0.91 | SMO (0.59) | SMOIKBKBNPY1RNPY2R | |
| SCHEMBL404517 | 0.84 | SMO (0.63) | SMO | |
| SCHEMBL4968684 | 0.83 | ALDH1A1 (0.44) | IKBKBNPY1RNPY2RTRPV1 | |
| SCHEMBL401969 | 0.82 | SMO (0.75) | SMO | |
| SCHEMBL4977786 | 0.80 | NPY1R (0.54) | NPY1RNPY2RTRPV1 | |
| SCHEMBL1071986 | 0.78 | SMO (0.53) | SMO | |
| SCHEMBL1069379 | 0.78 | SMO (0.53) | SMO | |
| SCHEMBL399580 | 0.77 | SMO (0.78) | SMOIKBKB | |
| SCHEMBL401245 | 0.77 | NPC1 (0.46) | SMOIKBKBNPY1RNPY2R | |
| SCHEMBL4975360 | 0.77 | CYP2C9 (0.56) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1957461-A1 | BISAMIDE INHIBITORS OF HEDGEHOG SIGNALING | Genentech, Inc. (US) | 2008-08-20 | — | — | EP | claimed |
| WO-2007059157-A1 | BISAMIDE INHIBITORS OF HEDGEHOG SIGNALING | GENENTECH, INC. (US) | 2007-05-24 | — | — | WO | claimed |