Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Atogepant. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL known ✓ | Q16602 | 20/20 | 1.00 |
| ▸ | RAMP1 | O60894 | 13/20 | 1.00 |
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 | |
|---|---|---|---|---|
| Atogepant SCHEMBL19750880 | 1.00 | CALCRL (1.00) | CALCRLRAMP1 | |
| Atogepant SCHEMBL30603188 | 1.00 | CALCRL (1.00) | CALCRLRAMP1 | |
| Atogepant SCHEMBL4570348 | 1.00 | CALCRL (1.00) | CALCRLRAMP1 | |
| Atogepant SCHEMBL29371653 | 1.00 | CALCRL (1.00) | CALCRLRAMP1 | |
| Atogepant SCHEMBL31611055 | 1.00 | CALCRL (1.00) | CALCRLRAMP1 | |
| Atogepant SCHEMBL16652662 | 0.99 | CALCRL (0.99) | CALCRLRAMP1 | |
| Atogepant SCHEMBL16653283 | 0.99 | CALCRL (0.99) | CALCRLRAMP1 | |
| Atogepant SCHEMBL16653020 | 0.99 | CALCRL (0.99) | CALCRLRAMP1 | |
| Atogepant SCHEMBL35210098 | 0.99 | CALCRL (0.99) | CALCRLRAMP1 | |
| Atogepant SCHEMBL16652952 | 0.99 | CALCRL (0.99) | CALCRLRAMP1 |
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-2020150703-A1 | CGRP ANTAGONISTS FOR TREATING MIGRAINE BREAKTHROUGH | BIOHAVEN PHARMACEUTICAL HOLDING COMPANY LTD. (US) | 2020-07-23 | — | — | WO | disclosed |