Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB2 | P05107 | 8/20 | 0.43 |
| ▸ | ICAM1 | P05362 | 8/20 | 0.43 |
| ▸ | ITGAL | P20701 | 8/20 | 0.43 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 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 | |
|---|---|---|---|---|
| SCHEMBL6240290 | 1.00 | ITGB2 (0.43) | ITGB2ICAM1ITGALPTGER3PTGER2 | |
| SCHEMBL6817329 | 0.86 | ITGB2 (0.52) | ITGB2ICAM1ITGALPTGER3PTGER2 | |
| SCHEMBL6568833 | 0.86 | ITGB2 (0.52) | ITGB2ICAM1ITGALPTGER3PTGER2 | |
| SCHEMBL6240384 | 0.83 | ALDH1A1 (0.44) | ITGB2ICAM1ITGALCA1CA2 | |
| SCHEMBL6240387 | 0.83 | ALDH1A1 (0.44) | ITGB2ICAM1ITGALCA1CA2 | |
| SCHEMBL6310691 | 0.79 | ITGB2 (0.39) | ITGB2ICAM1ITGALPTGER3PTGER2 | |
| SCHEMBL6310686 | 0.79 | ITGB2 (0.39) | ITGB2ICAM1ITGALPTGER3PTGER2 | |
| SCHEMBL8296823 | 0.77 | ITGB2 (0.52) | ITGB2ICAM1ITGALKDM4EHTT | |
| SCHEMBL6500029 | 0.77 | ITGAL (0.54) | ITGB2ICAM1ITGALMAPT | |
| SCHEMBL6500024 | 0.77 | ITGAL (0.54) | ITGB2ICAM1ITGALMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005019177-A1 | AMINOPIPERIDINE AMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-03-03 | — | — | WO | disclosed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |