Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAL | P20701 | 9/20 | 0.42 |
| ▸ | ITGB2 | P05107 | 8/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 8/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ADCY2 | Q08462 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17338998 | 1.00 | ITGAL (0.42) | ITGALITGB2ICAM1ATML3MBTL1 | |
| SCHEMBL18787390 | 1.00 | ITGAL (0.42) | ITGALITGB2ICAM1ATML3MBTL1 | |
| SCHEMBL17338997 | 1.00 | ITGAL (0.42) | ITGALITGB2ICAM1ATML3MBTL1 | |
| SCHEMBL17347096 | 1.00 | ITGAL (0.42) | ITGALITGB2ICAM1ATML3MBTL1 | |
| SCHEMBL17347061 | 1.00 | ITGAL (0.42) | ITGALITGB2ICAM1ATML3MBTL1 | |
| SCHEMBL17347068 | 0.83 | ALDH1A1 (0.48) | ATMALOX15MEN1ALDH1A1GAA | |
| SCHEMBL22898500 | 0.83 | ALDH1A1 (0.48) | ATMALOX15MEN1ALDH1A1GAA | |
| SCHEMBL17347124 | 0.83 | ALDH1A1 (0.48) | ATMALOX15MEN1ALDH1A1GAA | |
| SCHEMBL17338881 | 0.83 | ALDH1A1 (0.48) | ATMALOX15MEN1ALDH1A1GAA | |
| SCHEMBL18787456 | 0.83 | ALDH1A1 (0.48) | ATMALOX15MEN1ALDH1A1GAA |
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-3154941-A1 | SMALL MOLECULE LFA-1 INHIBITORS | AlloCyte Pharmaceuticals AG (CH) | 2017-04-19 | — | — | EP | disclosed |
| WO-2015189265-A1 | SMALL MOLECULE LFA-1 INHIBITORS | ALLOCYTE PHARMACEUTICALS AG (CH) | 2015-12-17 | — | — | WO | disclosed |