Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | ITGAL | P20701 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CCKAR | P32238 | 1/20 | 0.31 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.30 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22898655 | 0.77 | ADRA2A (0.44) | ADRA2AALDH1A1SMN1; SMN2LMNAITGB2 | |
| SCHEMBL17347075 | 0.75 | ALDH1A1 (0.47) | ADRA2AALDH1A1SMN1; SMN2LMNAITGB2 | |
| SCHEMBL17347159 | 0.75 | ALDH1A1 (0.47) | ADRA2AALDH1A1SMN1; SMN2LMNAITGB2 | |
| SCHEMBL18805124 | 0.75 | ALDH1A1 (0.47) | ADRA2AALDH1A1SMN1; SMN2LMNAITGB2 | |
| SCHEMBL20702205 | 0.75 | ALDH1A1 (0.47) | ADRA2AALDH1A1SMN1; SMN2LMNAITGB2 | |
| SCHEMBL22898600 | 0.75 | ALDH1A1 (0.47) | ADRA2AALDH1A1SMN1; SMN2LMNAITGB2 | |
| SCHEMBL22898673 | 0.75 | ALDH1A1 (0.47) | ADRA2AALDH1A1SMN1; SMN2LMNAITGB2 | |
| SCHEMBL22898574 | 0.75 | ALDH1A1 (0.47) | ADRA2AALDH1A1SMN1; SMN2LMNAITGB2 | |
| SCHEMBL17347072 | 0.75 | ALDH1A1 (0.47) | ADRA2AALDH1A1SMN1; SMN2LMNAITGB2 | |
| SCHEMBL22898568 | 0.73 | ITGAL (0.42) | ITGB2ICAM1ITGAL |
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 |