Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL21233397 | 0.77 | IDO1 (0.48) | IDO1TSHR | |
| SCHEMBL63291 | 0.76 | IDO1 (0.47) | IDO1 | |
| SCHEMBL25680596 | 0.76 | SIGMAR1 (0.36) | CXCR4TSHR | |
| Hydrochloric Acid SCHEMBL8194559 | 0.75 | IDO1 (0.46) | IDO1TSHR | |
| SCHEMBL12126049 | 0.74 | ACHE (0.42) | CXCR4TSHR | |
| SCHEMBL26431768 | 0.74 | KDM4E (0.42) | CXCR4TSHR | |
| SCHEMBL14899868 | 0.74 | IDO1 (0.52) | IDO1TSHR | |
| SCHEMBL17050035 | 0.74 | AOC1 (0.37) | CXCR4TSHR | |
| SCHEMBL19844318 | 0.70 | PTGS2 (0.36) | CXCR4TSHR | |
| SCHEMBL21779615 | 0.70 | GABRA1 (0.36) | CXCR4TSHR |
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-2018089648-A2 | DI-SULFIDE CONTAINING CELL PENETRATING PEPTIDES AND METHODS OF MAKING AND USING THEREOF | OHIO STATE INNOVATION FOUNDATION (US) | 2018-05-17 | — | — | WO | disclosed |