Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ITGAL | P20701 | 3/20 | 0.46 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.46 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.46 |
| ▸ | ELANE | P08246 | 3/20 | 0.41 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.40 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22898687 | 0.92 | TSHR (0.43) | TSHRITGALITGB2ICAM1ELANE | |
| SCHEMBL22898579 | 0.86 | TSHR (0.40) | TSHRITGALITGB2ICAM1ELANE | |
| SCHEMBL22898540 | 0.86 | TSHR (0.40) | TSHRITGALITGB2ICAM1ELANE | |
| SCHEMBL22898661 | 0.80 | TSHR (0.43) | TSHRELANEALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL22898633 | 0.80 | TSHR (0.43) | TSHRELANEALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL22898578 | 0.78 | TSHR (0.41) | TSHR | |
| SCHEMBL20715546 | 0.77 | ITGAL (0.48) | TSHRITGALITGB2ICAM1ELANE | |
| SCHEMBL22898659 | 0.76 | ITGAL (0.39) | TSHRITGALITGB2ICAM1ELANE | |
| SCHEMBL22898662 | 0.76 | ITGAL (0.39) | TSHRITGALITGB2ICAM1ELANE | |
| SCHEMBL18816188 | 0.73 | ALDH1A1 (0.52) | TSHRITGALITGB2ICAM1ELANE |
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 |
|---|---|---|---|---|---|---|---|
| EP-3154941-B1 | SMALL MOLECULE LFA-1 INHIBITORS | ALLOCYTE PHARMACEUTICALS AG (CH) | 2021-01-20 | — | — | EP | disclosed |