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 | |
|---|---|---|---|---|
| SCHEMBL14016998 | 0.98 | CALCRL (0.67) | CALCRLCYP3A4 | |
| SCHEMBL14016777 | 0.97 | CALCRL (0.69) | CALCRLCYP3A4 | |
| SCHEMBL14017285 | 0.95 | CALCRL (0.73) | CALCRLCYP3A4 | |
| SCHEMBL14017226 | 0.94 | CALCRL (0.74) | CALCRLCYP3A4 | |
| SCHEMBL14017195 | 0.94 | CALCRL (0.66) | CALCRLCYP3A4 | |
| SCHEMBL14017201 | 0.94 | CALCRL (0.65) | CALCRLCYP3A4 | |
| SCHEMBL13331923 | 0.94 | CALCRL (0.64) | CALCRLCYP3A4 | |
| SCHEMBL14017041 | 0.94 | CALCRL (0.61) | CALCRLCYP3A4 | |
| SCHEMBL14016899 | 0.93 | CALCRL (0.64) | CALCRLCYP3A4 | |
| SCHEMBL4923201 | 0.92 | CALCRL (0.61) | CALCRLCYP3A4 |
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-7439237-B2 | Selected CGRP-antagonists, process for preparing them and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-10-21 | — | — | US | disclosed |