Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | AKT1 | P31749 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CALCRL | Q16602 | 4/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | NPY1R | P25929 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAF1 | P04049 | 2/20 | 0.39 |
| ▸ | BRAF | P15056 | 2/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13985180 | 0.86 | SMN1; SMN2 (0.53) | SMN1; SMN2AKT1KDM4EPOLBNPSR1 | |
| SCHEMBL4755125 | 0.86 | TP53 (0.45) | SMN1; SMN2KDM4ECALCRLFLT3TP53 | |
| SCHEMBL13985082 | 0.77 | SMN1; SMN2 (0.53) | SMN1; SMN2KDM4EPOLBCALCRLALDH1A1 | |
| SCHEMBL1719715 | 0.73 | MEN1 (0.51) | KDM4EPOLBNPSR1TP53RAF1 | |
| SCHEMBL4756936 | 0.71 | CALCRL (0.53) | SMN1; SMN2KDM4EPOLBNPSR1CALCRL | |
| SCHEMBL4755723 | 0.71 | CSF1R (0.48) | KDM4EPOLBNPSR1RAF1BRAF | |
| SCHEMBL1717496 | 0.70 | SIRT2 (0.45) | SMN1; SMN2KDM4EPOLBNPSR1FLT3 | |
| SCHEMBL28987826 | 0.68 | SMN1; SMN2 (0.76) | SMN1; SMN2KDM4EPOLBTP53ALDH1A1 | |
| SCHEMBL28987838 | 0.67 | SMN1; SMN2 (0.80) | SMN1; SMN2KDM4EPOLBTP53ALDH1A1 | |
| SCHEMBL28987855 | 0.67 | SMN1; SMN2 (1.00) | SMN1; SMN2KDM4ENPSR1TP53ALDH1A1 |
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-2009000819-A1 | 5-PHENYL-1,3,4-OXADIAZOL-2-YL-ACETYL-4-PIPERIDINYL DERIVATIVES AS CGRP RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2008-12-31 | — | — | WO | disclosed |