Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 19/20 | 0.68 |
| ▸ | RAMP1 | O60894 | 3/20 | 0.68 |
| ▸ | CALCA | P06881 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14017754 | 0.96 | CALCRL (0.74) | CALCRLRAMP1CYP3A4 | |
| SCHEMBL14016471 | 0.96 | CALCRL (0.66) | CALCRLRAMP1CYP3A4 | |
| SCHEMBL14016422 | 0.93 | CALCRL (0.62) | CALCRLRAMP1CYP3A4 | |
| SCHEMBL14017760 | 0.92 | CALCRL (0.73) | CALCRLRAMP1CYP3A4 | |
| SCHEMBL2166421 | 0.91 | CALCRL (0.68) | CALCRLRAMP1CALCACYP3A4 | |
| SCHEMBL2166285 | 0.91 | CALCRL (0.81) | CALCRLRAMP1CYP3A4 | |
| SCHEMBL2166544 | 0.91 | CALCRL (0.68) | CALCRLRAMP1CALCACYP3A4 | |
| SCHEMBL2165054 | 0.91 | CALCRL (0.81) | CALCRLRAMP1CYP3A4 | |
| SCHEMBL14016819 | 0.91 | CALCRL (0.81) | CALCRLRAMP1CYP3A4 | |
| SCHEMBL2166425 | 0.91 | CALCRL (0.68) | CALCRLRAMP1CALCACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1863791-B1 | 2-OXO-1,2,4,5-TETRAHYDRO-1,3-BENZODIAZEPIN-3-YL-PIPERIDINES USED AS CGRP ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2008-11-12 | — | — | EP | disclosed |