Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | CALCRL | Q16602 | 15/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL5554711 | 0.80 | TP53 (0.36) | CALCRLTP53 | |
| SCHEMBL2901939 | 0.68 | CALCRL (0.39) | CALCRL | |
| SCHEMBL1198555 | 0.67 | KMT2A (0.33) | DRD4CALCRLKDM4E | |
| SCHEMBL5551836 | 0.64 | RPLP1 (0.40) | CALCRL | |
| SCHEMBL14343728 | 0.62 | CYP3A4 (0.38) | TP53 | |
| SCHEMBL5554731 | 0.62 | RAB9A (0.48) | CALCRLKDM4E | |
| SCHEMBL1198170 | 0.62 | CALCRL (0.39) | CALCRL | |
| SCHEMBL14346482 | 0.62 | CALCRL (0.39) | CALCRL | |
| SCHEMBL5555027 | 0.62 | CALCRL (0.39) | CALCRLTP53 | |
| SCHEMBL6885864 | 0.62 | CALCRL (0.41) | CALCRLTP53 |
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-1799672-A2 | CGRP RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 2007-06-27 | — | — | EP | disclosed |
| WO-2006041830-A2 | CGRP RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2006-04-20 | — | — | WO | disclosed |