Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 2/20 | 0.57 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.57 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.57 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | SLC7A5 | Q01650 | 3/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.46 |
| ▸ | ALPI | P09923 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | XIAP | P98170 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2857963 | 1.00 | ITGB1 (0.57) | ITGB1ITGA4ITGB7PTPN1SLC7A5 | |
| SCHEMBL2951695 | 0.88 | ALDH1A1 (0.59) | ITGB1ITGA4ITGB7PTPN1SLC7A5 | |
| SCHEMBL5013682 | 0.88 | ALDH1A1 (0.55) | ITGB1ITGA4ITGB7PTPN1SLC7A5 | |
| SCHEMBL5009929 | 0.87 | ALDH1A1 (0.62) | ITGB1ITGA4ITGB7PTPN1SLC7A5 | |
| SCHEMBL2058808 | 0.85 | ITGB1 (0.48) | ITGB1ITGA4ITGB7MAPTHSD17B10 | |
| SCHEMBL8058266 | 0.85 | PTPN1 (0.47) | ITGB1ITGA4ITGB7PTPN1SLC7A5 | |
| SCHEMBL21689918 | 0.85 | KMT2A (0.58) | PTPN1HSD17B10ALDH1A1TSHR | |
| SCHEMBL21690440 | 0.85 | KMT2A (0.58) | PTPN1HSD17B10ALDH1A1TSHR | |
| SCHEMBL8058263 | 0.85 | PTPN1 (0.47) | ITGB1ITGA4ITGB7PTPN1SLC7A5 | |
| SCHEMBL8048237 | 0.84 | ITGB1 (0.48) | ITGB1ITGA4ITGB7MAPTHSD17B10 |
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-1000051-A1 | CARBAMYLOXY COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | Elan Pharmaceuticals, Inc. (US) | 2000-05-17 | — | — | EP | disclosed |
| WO-1999006390-A1 | CARBAMYLOXY COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 1999-02-11 | — | — | WO | disclosed |