Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 17/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.33 |
| ▸ | RAMP1 | O60894 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4071585 | 0.84 | CALCRL (0.40) | CALCRLCHRM4RAMP1 | |
| SCHEMBL4083049 | 0.79 | CALCRL (0.50) | CALCRLCHRM4RAMP1CHRM1 | |
| SCHEMBL4072291 | 0.78 | CALCRL (0.37) | CALCRLCHRM4RAMP1CHRM1 | |
| SCHEMBL3954165 | 0.77 | TP53 (0.46) | CALCRLRAMP1 | |
| SCHEMBL14410191 | 0.76 | PARP1 (0.40) | CALCRLHPGDRAMP1 | |
| SCHEMBL4074982 | 0.73 | CALCRL (0.48) | CALCRLCHRM4RAMP1 | |
| SCHEMBL4079724 | 0.68 | PDE3B (0.40) | — | |
| SCHEMBL2212650 | 0.68 | CHRM4 (0.50) | CALCRLCHRM4RAMP1CHRM1 | |
| SCHEMBL3278238 | 0.66 | HPGD (0.40) | HPGD | |
| SCHEMBL2103739 | 0.62 | CALCRL (0.58) | CALCRLCHRM4RAMP1 |
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-2108648-A1 | Selected CGRP antagonists, method for their manufacture and use as medicines | Boehringer Ingelheim International GmbH (DE) | 2009-10-14 | — | — | EP | disclosed |
| EP-1732917-B1 | SELECTED CGRP ANTAGONISTS, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA (DE) | 2009-07-29 | — | — | EP | disclosed |