Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTN3A1 | O00481 | 1/20 | 0.44 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.41 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 2/20 | 0.39 |
| ▸ | CTSV | O60911 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | EYA2 | O00167 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18973578 | 0.86 | BTN3A1 (0.46) | BTN3A1ITGA4ITGB7MEN1KMT2A | |
| SCHEMBL18973566 | 0.86 | ALDH1A1 (0.46) | BTN3A1ITGA4ITGB7MEN1KMT2A | |
| SCHEMBL18973575 | 0.86 | BTN3A1 (0.46) | BTN3A1ITGA4ITGB7MEN1KMT2A | |
| SCHEMBL18973687 | 0.85 | BTN3A1 (0.46) | BTN3A1MAPTELANECTSLGAA | |
| SCHEMBL22065784 | 0.85 | BTN3A1 (0.46) | BTN3A1MEN1KMT2AELANECTSL | |
| SCHEMBL22066288 | 0.85 | BTN3A1 (0.50) | BTN3A1ELANECTSLSMN1; SMN2PRTN3 | |
| SCHEMBL18953048 | 0.85 | BTN3A1 (0.52) | BTN3A1ITGA4ITGB7MEN1KMT2A | |
| SCHEMBL18973479 | 0.85 | BTN3A1 (0.52) | BTN3A1ITGA4ITGB7MEN1KMT2A | |
| SCHEMBL17403978 | 0.85 | BTN3A1 (0.52) | BTN3A1ITGA4ITGB7MEN1KMT2A | |
| SCHEMBL18973682 | 0.84 | BTN3A1 (0.44) | BTN3A1MEN1KMT2AMAPTELANE |
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-2017098252-A1 | DIASTEREOSELECTIVE SYNTHESIS OF PHOSPHATE DERIVATIVES AND OF THE GEMCITABINE PRODRUG NUC-1031 | NUCANA BIOMED LIMITED (GB) | 2017-06-15 | — | — | WO | disclosed |