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 | |
|---|---|---|---|---|
| SCHEMBL27959472 | 0.74 | CHRM3 (0.35) | RIPK1 | |
| SCHEMBL17552745 | 0.70 | NPC1 (0.37) | IDO1RIPK1 | |
| SCHEMBL21868839 | 0.70 | ESR1 (0.33) | IDO1RIPK1 | |
| SCHEMBL1237730 | 0.69 | PDE2A (0.39) | IDO1 | |
| SCHEMBL14191886 | 0.68 | IDO1 (0.33) | IDO1 | |
| Hydrochloric Acid SCHEMBL3162563 | 0.67 | PDE2A (0.38) | IDO1 | |
| SCHEMBL26394645 | 0.67 | RIPK1 (0.30) | RIPK1 | |
| SCHEMBL4371812 | 0.67 | — | — | |
| SCHEMBL18465139 | 0.67 | IDO1 (0.32) | IDO1RIPK1 | |
| SCHEMBL7356658 | 0.66 | CES2 (0.36) | RIPK1 |
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-2458991-A1 | RADIOLABELED CGRP ANTAGONISTS | Merck Sharp & Dohme Corp. (US) | 2012-06-06 | — | — | EP | disclosed |
| WO-2011014383-A1 | RADIOLABELED CGRP ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-02-03 | — | — | WO | disclosed |