Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 17/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3778714 | 0.80 | CALCRL (0.73) | CALCRLCYP3A4 | |
| SCHEMBL3777301 | 0.76 | CALCRL (0.41) | CALCRLCYP3A4 | |
| SCHEMBL13747646 | 0.73 | CALCRL (0.63) | CALCRLCYP3A4 | |
| SCHEMBL14146301 | 0.65 | CALCRL (0.50) | CALCRLCYP3A4 | |
| SCHEMBL4560453 | 0.64 | CALCRL (1.00) | CALCRLCYP3A4 | |
| SCHEMBL442897 | 0.64 | CALCRL (1.00) | CALCRLCYP3A4 | |
| SCHEMBL3780298 | 0.62 | CALCRL (0.59) | CALCRL | |
| SCHEMBL4227619 | 0.62 | CALCRL (0.77) | CALCRLCYP3A4 | |
| SCHEMBL3627128 | 0.61 | CALCRL (0.41) | CALCRLCYP3A4 | |
| SCHEMBL4054553 | 0.61 | CALCRL (0.79) | 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 |
|---|---|---|---|---|---|---|---|
| WO-2009105348-A1 | IMIDAZOBENZAZEPINE CGRP RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2009-08-27 | — | — | WO | disclosed |